SCHEMBL7417376

SCHEMBL7417376

N=C(N)c1ccc(N2CC[C@@H](CC(=O)NC=CCCC(=O)O)C2=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.43
ITGA2B P08514 20/20 0.43

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
SCHEMBL7417379 1.00 ITGB3 (0.43) ITGB3ITGA2B
SCHEMBL7419097 0.94 ITGB3 (0.42) ITGB3ITGA2B
SCHEMBL7419100 0.94 ITGB3 (0.42) ITGB3ITGA2B
SCHEMBL27351410 0.87 ITGB3 (0.56) ITGB3ITGA2B
SCHEMBL7413731 0.87 ITGB3 (0.56) ITGB3ITGA2B
SCHEMBL7419652 0.83 ITGB3 (0.53) ITGB3ITGA2B
SCHEMBL7425949 0.83 ITGB3 (0.57) ITGB3ITGA2B
SCHEMBL9028819 0.83 ITGB3 (0.57) ITGB3ITGA2B
SCHEMBL27351404 0.82 ITGB3 (0.53) ITGB3ITGA2B
SCHEMBL9029210 0.81 ITGB3 (0.53) ITGB3ITGA2B

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
CN-1054842-C Platelet aggregation inhibitors SEARLE & CO (US) 2000-07-26 CN claimed
JP-3034046-B2 2000-04-17 JP claimed
CN-1124957-A 1-amidinophenyl-pyrrolidones piperidinones azetinones as platelet aggregation inhibitors SEARLE & CO (US) 1996-06-19 CN claimed
EP-0691953-A1 1-AMIDINOPHENYL-PYRROLIDONES PIPERIDINONES AZETINONES AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1996-01-17 EP claimed
WO-1994022820-A1 1-AMIDINOPHENYL-PYRROLIDONES PIPERIDINONES AZETINONES AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1994-10-13 WO claimed
CN-1054842-C Platelet aggregation inhibitors SEARLE & CO (US) 2000-07-26 CN disclosed
CN-1124957-A 1-amidinophenyl-pyrrolidones piperidinones azetinones as platelet aggregation inhibitors SEARLE & CO (US) 1996-06-19 CN disclosed