SCHEMBL7301374

SCHEMBL7301374

CCOC(=O)CC1CCc2ccc(C(=O)N(C)c3ccc(C(=N)N)cc3)cc2C1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 14/20 0.50
ITGA2B P08514 14/20 0.50
PLAU P00749 1/20 0.40
F2 P00734 4/20 0.36
F10 P00742 3/20 0.36
LMNA P02545 1/20 0.35

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
SCHEMBL7311321 0.94 ITGB3 (0.50) ITGB3ITGA2BPLAUF2F10
SCHEMBL7301227 0.91 ITGB3 (0.40) ITGB3ITGA2BLMNA
SCHEMBL7307341 0.89 ITGB3 (0.50) ITGB3ITGA2BPLAU
SCHEMBL7304039 0.87 ITGB3 (0.65) ITGB3ITGA2BPLAU
SCHEMBL7306377 0.86 ITGB3 (0.40) ITGB3ITGA2B
SCHEMBL7309097 0.85 ITGB3 (0.47) ITGB3ITGA2BPLAU
SCHEMBL7392479 0.84 ITGB3 (0.44) ITGB3ITGA2BF2F10
SCHEMBL7398673 0.84 ITGB3 (0.55) ITGB3ITGA2BLMNA
SCHEMBL7392906 0.84 ITGB3 (0.55) ITGB3ITGA2BF2F10
SCHEMBL7308742 0.84 ITGB3 (0.66) ITGB3ITGA2BPLAUF2F10

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