SCHEMBL6162448

SCHEMBL6162448

NC(=O)c1ccsc1CNC(=O)[CH]Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 13/20 0.47
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 4/20 0.39
MAPK10 P53779 3/20 0.39
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LMNA P02545 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL4073041 0.75 ALDH1A1 (0.62) SMN1; SMN2ALDH1A1LMNACYP2D6CYP2C19
SCHEMBL31689136 0.74 MAPK8 (0.55) MAPK8NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL8623265 0.74 LMNA (0.64) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL13147514 0.73 NPC1 (0.58) MAPK8NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL14861310 0.73 LMNA (0.50) ALDH1A1LMNACYP2D6CYP2C19KMT2A
SCHEMBL3345536 0.71 HTT (0.41) NPC1RAB9AALDH1A1LMNACYP2D6
SCHEMBL631087 0.68 MAPK8 (0.49) MAPK8NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL18343734 0.68 ALDH1A1 (0.46) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL4071827 0.68 ALDH1A1 (0.60) SMN1; SMN2ALDH1A1MAPTLMNACYP2D6
SCHEMBL6167127 0.68 TAAR1 (0.48) SMN1; SMN2ALDH1A1KMT2AKDM4E

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 6 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
WO-1996039384-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER, INC. (US) 1996-12-12 WO disclosed