SCHEMBL7329192

SCHEMBL7329192

CC(CC(=O)OC(=O)C(F)(F)F)N1CC(=O)N(C)c2ccc(CCCCCN)cc2C1=O

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 5/20 0.44
ITGA2B P08514 5/20 0.44
RXRA P19793 1/20 0.30

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
SCHEMBL7326445 0.91 ITGB3 (0.35) ITGB3ITGA2BRXRA
SCHEMBL9009310 0.89 ITGB3 (0.37) ITGB3ITGA2B
SCHEMBL7331386 0.89 ITGB3 (0.37) ITGB3ITGA2B
SCHEMBL7329497 0.88 ITGB3 (0.42) ITGB3ITGA2B
SCHEMBL7333455 0.88 ITGB3 (0.45) ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7329185 0.88 ITGB3 (0.53) ITGB3ITGA2BRXRA
SCHEMBL7330697 0.88 ITGB3 (0.35) ITGB3ITGA2B
SCHEMBL7331333 0.87 PTGDR2 (0.35) ITGB3ITGA2B
SCHEMBL7322230 0.85 ITGB3 (0.39) ITGB3ITGA2B
SCHEMBL7331761 0.84 ITGB3 (0.40) ITGB3ITGA2BRXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5674863-A BENZODIAZEPINEDIONE DERIVATIVE; FIBRINOGIN BINDING INHIBITOR GENENTECH, INC. (US) 1997-10-07 US disclosed
US-5674865-A BENZODIAZEPINEDIONE DERIVATIVE; FIBRINOGIN BINDING INHIBITOR GENENTECH, INC. (US) 1997-10-07 US disclosed
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
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 EP disclosed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed