SCHEMBL7425624

SCHEMBL7425624

CCC(C(=O)O)N1CC(=O)N(Cc2ccc(F)cc2F)c2ccc(NC(=O)c3ccc(C(=N)N)cc3)cc2C1=O

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 16/20 0.42
ITGA2B P08514 16/20 0.42
F2 P00734 2/20 0.39
KLKB1 P03952 1/20 0.36
F10 P00742 1/20 0.35
FSCN1 Q16658 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
SCHEMBL7359512 0.86 ITGB3 (0.41) ITGB3ITGA2BF2F10
SCHEMBL7421352 0.85 ITGB3 (0.45) ITGB3ITGA2B
SCHEMBL7425883 0.84 ITGB3 (0.46) ITGB3ITGA2BF2F10
SCHEMBL7361166 0.84 ITGB3 (0.49) ITGB3ITGA2B
SCHEMBL7421820 0.83 ITGB3 (0.59) ITGB3ITGA2BF2KLKB1
SCHEMBL7429236 0.82 ITGB3 (0.54) ITGB3ITGA2BF2F10
SCHEMBL7427456 0.81 ITGB3 (0.47) ITGB3ITGA2BF2F10
SCHEMBL7430434 0.78 ITGB3 (0.45) ITGB3ITGA2BF2F10
SCHEMBL8959433 0.78 EDNRB (0.36) ITGB3ITGA2BF2
SCHEMBL7361582 0.77 EDNRB (0.34)

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-0610334-B1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII B III A RECEPTOR GENENTECH INC (US) 1996-01-24 EP claimed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO claimed
US-5663166-A ANTICOAGULANTS OF 1,4-BENZODIAZEPINE-2,5-DIONE AND 2-BENZOAZEPINE-1,4-DIONE DERIVATIVES; PREVENTS FIBRINOGEN BINDING NECESSARY FOR PLATELET AGGREGATION; SIDE EFFECT REDUCTION, E.G. EXCESSIVE BLEEDING GENENTECH, INC. (US) 1997-09-02 US disclosed
US-5565449-A PLATELET AGGREGATION INHIBITORS GENENTECH, INC. (US) 1996-10-15 US disclosed
EP-0610334-B1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII B III A RECEPTOR GENENTECH INC (US) 1996-01-24 EP disclosed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed