SCHEMBL4246964

SCHEMBL4246964

N#CC1(NC(=O)[CH]CC(F)(F)Cc2cccc(C(N)=O)c2F)CC1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSL P07711 11/20 0.37
CTSS P25774 10/20 0.37
CTSB P07858 9/20 0.37
CTSK P43235 6/20 0.34
CTSC P53634 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4066120 0.91 CTSL (0.37) CTSLCTSSCTSBCTSKCTSC
SCHEMBL4245581 0.84 CTSL (0.39) CTSLCTSSCTSBCTSK
SCHEMBL4069051 0.82 CTSK (0.35) CTSLCTSSCTSBCTSKCTSC
SCHEMBL4069813 0.81 CTSK (0.34) CTSLCTSSCTSBCTSKCTSC
SCHEMBL4246746 0.80 CTSL (0.36) CTSLCTSSCTSBCTSK
SCHEMBL4239823 0.77 CTSS (0.51) CTSLCTSSCTSBCTSK
SCHEMBL4248166 0.73 LOXL2 (0.36) CTSLCTSSCTSBCTSK
SCHEMBL4243855 0.73 CTSK (0.33) CTSLCTSSCTSBCTSKCTSC
SCHEMBL4241257 0.72 CTSL (0.37) CTSLCTSSCTSBCTSKCTSC
SCHEMBL3881247 0.71 CTSK (0.34) CTSLCTSSCTSBCTSKCTSC

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2520568-B1 Spirocyclic nitriles as inhibitors of protease SANOFI SA (FR) 2015-09-09 EP disclosed
EP-2520568-A1 Spirocyclic nitriles as inhibitors of protease SANOFI (FR) 2012-11-07 EP disclosed
EP-2032535-B1 SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS SANOFI SA (FR) 2012-08-01 EP disclosed
EP-2032535-A1 SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS Sanofi-Aventis (FR) 2009-03-11 EP disclosed
WO-2007137738-A1 SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS SANOFI-AVENTIS (DE) 2007-12-06 WO disclosed