SCHEMBL6162474

SCHEMBL6162474

CN(C)C(=O)C(Cc1ccccc1)NC(=O)OC(C)(C)C

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSS P25774 8/20 0.64
CTSK P43235 7/20 0.64
CTSB P07858 2/20 0.64
CTSL P07711 1/20 0.64
MMP9 P14780 1/20 0.61
MMP8 P22894 1/20 0.61
MMP14 P50281 1/20 0.61
ACE P12821 1/20 0.61
ATM Q13315 1/20 0.56
AKT1 P31749 1/20 0.56
KLK5 Q9Y337 1/20 0.54
PPARA Q07869 2/20 0.53
PPARG P37231 1/20 0.53
APP P05067 1/20 0.52

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
SCHEMBL1764798 1.00 CTSS (0.64) CTSSCTSKCTSBCTSLMMP9
SCHEMBL3701014 0.94 CTSS (0.66) CTSSCTSKCTSBCTSLMMP9
SCHEMBL3701013 0.94 CTSS (0.66) CTSSCTSKCTSBCTSLMMP9
SCHEMBL4654379 0.90 CTSS (0.61) CTSSCTSKCTSBCTSLACE
SCHEMBL4654386 0.90 CTSS (0.61) CTSSCTSKCTSBCTSLACE
SCHEMBL1204211 0.88 JAK3 (0.61) CTSSCTSKCTSBCTSLACE
SCHEMBL8894210 0.88 CTSS (0.60) CTSSCTSKCTSBCTSLACE
SCHEMBL18057248 0.88 CTSS (0.60) CTSSCTSKCTSBCTSLACE
SCHEMBL19969174 0.88 CTSS (0.60) CTSSCTSKCTSBCTSLACE
SCHEMBL6557659 0.88 JAK3 (0.61) CTSSCTSKCTSBCTSLACE

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1134213-B1 Process for the preparation of substituted N-(indole-2-carbonyl)- glycinamides PFIZER (US) 2005-11-02 EP disclosed
EP-0832065-B1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER (US) 2001-10-10 EP disclosed
EP-1134213-A2 Process for the preparation of substituted N-(indole-2-carbonyl)- glycinamides PFIZER INC. (US) 2001-09-19 EP disclosed
US-6277877-B1 GLYCOGEN PHOSPHORYLASE INHIBITOR; ANTIDIABETIC AGENTS PFIZER, INC. 2001-08-21 US disclosed
US-6107329-A HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS PFIZER, INC. (US) 2000-08-22 US disclosed
EP-0832065-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER INC. (US) 1998-04-01 EP disclosed
WO-1996039384-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER, INC. (US) 1996-12-12 WO disclosed