SCHEMBL7416622

SCHEMBL7416622

NN=Cc1ccc(N2CCCC(CC(=O)NC(C#Cc3ccccc3)CC(=O)O)C2=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 7/20 0.42
ITGA2B P08514 7/20 0.42
F2R P25116 1/20 0.40
LGMN Q99538 1/20 0.34
F2 P00734 2/20 0.32
IL2RA P01589 1/20 0.32
ALB P02768 1/20 0.32
IL2 P60568 1/20 0.32
CASP1 P29466 2/20 0.31
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP12 P39900 1/20 0.30
F10 P00742 1/20 0.30

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
SCHEMBL7417576 0.91 ITGB3 (0.35) ITGB3ITGA2BF2RLGMNIL2RA
SCHEMBL7417001 0.88 ITGB3 (0.44) ITGB3ITGA2B
SCHEMBL7421385 0.88 ITGB3 (0.44) ITGB3ITGA2B
SCHEMBL7418297 0.87 ITGB3 (0.54) ITGB3ITGA2B
SCHEMBL7422459 0.87 ITGB3 (0.54) ITGB3ITGA2B
SCHEMBL7422085 0.87 ITGB3 (0.42) ITGB3ITGA2BF2R
SCHEMBL7416611 0.85 ITGB3 (0.43) ITGB3ITGA2BF2RIL2RAALB
SCHEMBL8117653 0.84 ITGB3 (0.33) ITGB3ITGA2BF2IL2RAALB
SCHEMBL7419412 0.84 ITGB3 (0.46) ITGB3ITGA2BF2R
SCHEMBL8117264 0.83 ITGB3 (0.42) 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0691953-B1 1-AMIDINOPHENYL-PYRROLIDONES/ PIPERIDINONES AS PLATELET AGGREGATION INHIBITORS SEARLE & CO (US) 2000-08-02 EP claimed
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
EP-0691953-B1 1-AMIDINOPHENYL-PYRROLIDONES/ PIPERIDINONES AS PLATELET AGGREGATION INHIBITORS SEARLE & CO (US) 2000-08-02 EP disclosed
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
EP-0691953-A1 1-AMIDINOPHENYL-PYRROLIDONES PIPERIDINONES AZETINONES AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1996-01-17 EP disclosed
WO-1994022820-A1 1-AMIDINOPHENYL-PYRROLIDONES PIPERIDINONES AZETINONES AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1994-10-13 WO disclosed