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Discovery of Trifluoromethyl Glycol Carbamates as Potent and Selective Covalent Monoacylglycerol Lipase (MAGL) Inhibitors for Treatment of Neuroinflammation

Authors :
Timothy L. Foley
Justin I. Montgomery
Daniel P. Uccello
Anthony R. Harris
Steven Victor O'neil
Bruce N. Rogers
Douglas S. Johnson
Justin R. Piro
Tarek A. Samad
Christopher Ryan Butler
Stephen Noell
Rafael G. Silva
Deane M. Nason
Christopher John Helal
Adam M. Gilbert
Julie Cianfrogna
Laura A. McAllister
Scot Richard Mente
Christopher L. Shaffer
Kari R. Fonseca
Damien Webb
Jayvardhan Pandit
Michael Aaron Brodney
Source :
Journal of medicinal chemistry. 61(7)
Publication Year :
2018

Abstract

Monoacylglycerol lipase (MAGL) inhibition provides a potential treatment approach to neuroinflammation through modulation of both the endocannabinoid pathway and arachidonoyl signaling in the central nervous system (CNS). Herein we report the discovery of compound 15 (PF-06795071), a potent and selective covalent MAGL inhibitor, featuring a novel trifluoromethyl glycol leaving group that confers significant physicochemical property improvements as compared with earlier inhibitor series with more lipophilic leaving groups. The design strategy focused on identifying an optimized leaving group that delivers MAGL potency, serine hydrolase selectivity, and CNS exposure while simultaneously reducing log D, improving solubility, and minimizing chemical lability. Compound 15 achieves excellent CNS exposure, extended 2-AG elevation effect in vivo, and decreased brain inflammatory markers in response to an inflammatory challenge.

Details

ISSN :
15204804
Volume :
61
Issue :
7
Database :
OpenAIRE
Journal :
Journal of medicinal chemistry
Accession number :
edsair.doi.dedup.....67ba4448563e7b467bb25a055a46ddd6