SCHEMBL7417192

SCHEMBL7417192

C=CC(CC(=O)OCC)NC(=O)N[C@H]1CCN(c2ccc(C(=N)N)cc2)C1=O

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 16/20 0.67
ITGA2B P08514 16/20 0.67
PRSS1 P07477 6/20 0.39
PRSS2 P07478 6/20 0.39
PRSS3 P35030 6/20 0.39
F10 P00742 4/20 0.38
F2 P00734 2/20 0.38
F9 P00740 1/20 0.37
FPR1 P21462 1/20 0.37
FPR2 P25090 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
SCHEMBL7417201 1.00 ITGB3 (0.67) ITGB3ITGA2BPRSS1PRSS2PRSS3
SCHEMBL7417196 1.00 ITGB3 (0.67) ITGB3ITGA2BPRSS1PRSS2PRSS3
SCHEMBL7418392 0.89 ITGB3 (0.54) ITGB3ITGA2BFPR1FPR2
SCHEMBL7418384 0.89 ITGB3 (0.54) ITGB3ITGA2BFPR1FPR2
SCHEMBL7418373 0.89 ITGB3 (0.54) ITGB3ITGA2BFPR1FPR2
SCHEMBL8108543 0.88 ITGB3 (0.71) ITGB3ITGA2BPRSS1PRSS2PRSS3
SCHEMBL8115160 0.88 ITGB3 (0.71) ITGB3ITGA2BPRSS1PRSS2PRSS3
Acetic Acid SCHEMBL7414160 0.87 ITGB3 (0.68) ITGB3ITGA2BPRSS1PRSS2PRSS3
SCHEMBL7417207 0.86 ITGB3 (0.49) ITGB3ITGA2BFPR1FPR2
SCHEMBL7413725 0.85 ITGB3 (0.52) ITGB3ITGA2BPRSS1PRSS2PRSS3

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-0691953-B1 1-AMIDINOPHENYL-PYRROLIDONES/ PIPERIDINONES AS PLATELET AGGREGATION INHIBITORS SEARLE & CO (US) 2000-08-02 EP claimed
JP-3034046-B2 2000-04-17 JP 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
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