SCHEMBL6161903

SCHEMBL6161903

CNC(=O)C(Cc1cscn1)NC(=O)OC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.54
CTSS P25774 13/20 0.46
CTSK P43235 12/20 0.46
CAPN1 P07384 1/20 0.43
CTSL P07711 2/20 0.42
CTSB P07858 1/20 0.42
HDAC8 Q9BY41 1/20 0.40
PTPRB P23467 2/20 0.39
GPR142 Q7Z601 1/20 0.38

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
SCHEMBL6161893 1.00 SCN9A (0.54) SCN9ACTSSCTSKCAPN1CTSL
SCHEMBL478735 0.88 SCN9A (0.53) SCN9ACTSSCTSKCAPN1CTSL
SCHEMBL5717580 0.88 SCN9A (0.53) SCN9ACTSSCTSKCAPN1CTSL
SCHEMBL478732 0.88 SCN9A (0.53) SCN9ACTSSCTSKCAPN1CTSL
SCHEMBL23324594 0.86 SCN9A (0.50) SCN9ACTSSCTSKCAPN1CTSL
SCHEMBL25888951 0.86 SCN9A (0.50) SCN9ACTSSCTSKCAPN1CTSL
Hydrochloric Acid SCHEMBL28584085 0.86 SCN9A (0.52) SCN9ACTSSCTSKCAPN1CTSL
SCHEMBL6162654 0.84 SCN9A (0.51) SCN9ACTSSCTSKCAPN1CTSL
SCHEMBL6162648 0.84 SCN9A (0.51) SCN9ACTSSCTSKCAPN1CTSL
Dimethylamine SCHEMBL9052850 0.84 SCN9A (0.49) SCN9ACTSSCTSKCAPN1CTSL

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