SCHEMBL7307341

SCHEMBL7307341

CN(C(=O)c1ccc2c(c1)CC(CC(=O)OC(C)(C)C)CC2)c1ccc(C(=N)N)cc1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 17/20 0.50
ITGA2B P08514 17/20 0.50
PLAU P00749 1/20 0.40
MCHR1 Q99705 1/20 0.34

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
SCHEMBL7301374 0.89 ITGB3 (0.50) ITGB3ITGA2BPLAU
SCHEMBL7304039 0.87 ITGB3 (0.65) ITGB3ITGA2BPLAU
SCHEMBL7295945 0.86 MCHR1 (0.45) ITGB3ITGA2BMCHR1
SCHEMBL7308603 0.84 ITGB3 (0.66) ITGB3ITGA2BPLAUMCHR1
SCHEMBL7311321 0.83 ITGB3 (0.50) ITGB3ITGA2BPLAU
SCHEMBL7300538 0.82 ITGB3 (0.75) ITGB3ITGA2BPLAUMCHR1
SCHEMBL7306183 0.81 ITGB3 (0.65) ITGB3ITGA2BPLAU
SCHEMBL7309097 0.80 ITGB3 (0.47) ITGB3ITGA2BPLAUMCHR1
SCHEMBL7309674 0.80 ITGB3 (0.61) ITGB3ITGA2BMCHR1
SCHEMBL7301227 0.80 ITGB3 (0.40) ITGB3ITGA2BMCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0709370-B1 Bicyclic compounds useful as platelet aggregation inhibitors MITSUI CHEMICALS INC (JP) 1999-01-13 EP disclosed
US-5629321-A FIBRINOGEN ANTAGONIST MITSUI TOATSU CHEMICALS, INC. (JP) 1997-05-13 US disclosed
EP-0709370-A1 Bicyclic compounds useful as platelet aggregation inhibitors MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-05-01 EP disclosed