SCHEMBL7308742

SCHEMBL7308742

CCOC(=O)CC1CCc2ccc(C(=O)Nc3ccc(C(=N)N)cc3)cc2C1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 13/20 0.66
ITGA2B P08514 13/20 0.66
PLAU P00749 3/20 0.44
F2 P00734 2/20 0.43
PLAT P00750 2/20 0.43
PLG P00747 1/20 0.43
KLKB1 P03952 1/20 0.43
PRSS1 P07477 1/20 0.43
MCHR1 Q99705 1/20 0.43
F10 P00742 1/20 0.42

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
SCHEMBL7305013 0.94 ITGB3 (0.58) ITGB3ITGA2BMCHR1
SCHEMBL7299155 0.94 ITGB3 (0.75) ITGB3ITGA2BPLAUMCHR1
Hydrochloric Acid SCHEMBL7315353 0.93 ITGB3 (0.74) ITGB3ITGA2BPLAUMCHR1
SCHEMBL7303485 0.93 ITGB3 (0.64) ITGB3ITGA2BPLAUF2PLAT
SCHEMBL7306968 0.91 ITGB3 (0.70) ITGB3ITGA2BPLAUMCHR1
SCHEMBL7304439 0.91 ITGB3 (0.62) ITGB3ITGA2BPLAU
SCHEMBL7302786 0.90 ITGB3 (0.65) ITGB3ITGA2BMCHR1
SCHEMBL7295966 0.89 ITGB3 (0.67) ITGB3ITGA2BPLAUF2PLAT
SCHEMBL7308603 0.89 ITGB3 (0.66) ITGB3ITGA2BPLAUMCHR1
SCHEMBL7302139 0.88 ITGB3 (0.63) ITGB3ITGA2BPLAUF2PLAT

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