SCHEMBL7418876

SCHEMBL7418876

N=C(N)c1ccc(N2CCC(NC(=O)Nc3cccc(CCC(=O)OC(=O)C(F)(F)F)c3)C2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 2/20 0.51
ITGA2B P08514 2/20 0.51
FPR2 P25090 17/20 0.43
FPR1 P21462 11/20 0.43
F10 P00742 1/20 0.41
HPN P05981 1/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
HGFAC Q04756 1/20 0.41
ST14 Q9Y5Y6 1/20 0.41

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
Trifluoroacetic Acid SCHEMBL9027645 0.89 ITGB3 (0.53) ITGB3ITGA2BFPR2FPR1F10
Trifluoroacetic Acid SCHEMBL7418870 0.89 ITGB3 (0.53) ITGB3ITGA2BFPR2FPR1F10
Trifluoroacetic Acid SCHEMBL7422390 0.88 ITGB3 (0.62) ITGB3ITGA2BFPR2FPR1F10
SCHEMBL8117283 0.87 ITGB3 (0.68) ITGB3ITGA2BFPR2FPR1F10
SCHEMBL8117290 0.87 ITGB3 (0.68) ITGB3ITGA2BFPR2FPR1F10
SCHEMBL8116032 0.86 ITGB3 (0.57) ITGB3ITGA2BFPR2FPR1F10
SCHEMBL8116018 0.86 ITGB3 (0.57) ITGB3ITGA2BFPR2FPR1F10
SCHEMBL7448817 0.82 ITGB3 (0.73) ITGB3ITGA2BFPR2FPR1
SCHEMBL7411805 0.82 ITGB3 (0.73) ITGB3ITGA2BFPR2FPR1
SCHEMBL9029031 0.81 ITGB3 (0.66) ITGB3ITGA2BFPR2FPR1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3034046-B2 2000-04-17 JP 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-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