SCHEMBL6162648

SCHEMBL6162648

CN(C)C(=O)[C@H](Cc1cscn1)NC(=O)OC(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.51
CTSK P43235 10/20 0.40
CTSS P25774 10/20 0.40
CTSL P07711 2/20 0.37
CTSB P07858 1/20 0.37
CAPN1 P07384 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
PTPRB P23467 1/20 0.36
ACE P12821 1/20 0.35
JAK3 P52333 1/20 0.35
BTK Q06187 1/20 0.35
OPRL1 P41146 1/20 0.35

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
SCHEMBL6162654 1.00 SCN9A (0.51) SCN9ACTSKCTSSCTSLCTSB
Dimethylamine SCHEMBL9052850 0.97 SCN9A (0.49) SCN9ACTSKCTSSCTSLCTSB
SCHEMBL478735 0.86 SCN9A (0.53) SCN9ACTSKCTSSCTSLCTSB
SCHEMBL478732 0.86 SCN9A (0.53) SCN9ACTSKCTSSCTSLCTSB
SCHEMBL5717580 0.86 SCN9A (0.53) SCN9ACTSKCTSSCTSLCTSB
SCHEMBL23324594 0.85 SCN9A (0.50) SCN9ACTSKCTSSCTSLCTSB
Hydrochloric Acid SCHEMBL28584085 0.85 SCN9A (0.52) SCN9ACTSKCTSSCTSLCTSB
SCHEMBL25888951 0.85 SCN9A (0.50) SCN9ACTSKCTSSCTSLCTSB
SCHEMBL6161893 0.84 SCN9A (0.54) SCN9ACTSKCTSSCTSLCTSB
SCHEMBL6161903 0.84 SCN9A (0.54) SCN9ACTSKCTSSCTSLCTSB

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