SCHEMBL7323748

SCHEMBL7323748

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

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 6/20 0.37
ITGA2B P08514 6/20 0.37
RXRA P19793 2/20 0.31
NPY4R P50391 2/20 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
SCHEMBL7333455 0.92 ITGB3 (0.45) ITGB3ITGA2BNPY4R
SCHEMBL7331609 0.91 ITGB3 (0.33) ITGB3ITGA2BRXRA
SCHEMBL7325465 0.90 ITGB3 (0.36) ITGB3ITGA2BRXRA
Trifluoroacetic Acid SCHEMBL7323741 0.89 ITGB3 (0.44) ITGB3ITGA2BRXRANPY4R
SCHEMBL7333911 0.88 ITGB3 (0.37) ITGB3ITGA2BNPY4R
SCHEMBL7326445 0.88 ITGB3 (0.35) ITGB3ITGA2BRXRA
SCHEMBL7330483 0.88 ITGB3 (0.36) ITGB3ITGA2B
SCHEMBL8842976 0.87 ITGB3 (0.36) ITGB3ITGA2BRXRA
SCHEMBL7321434 0.85 ITGB3 (0.44) ITGB3ITGA2B
SCHEMBL7327769 0.84 ITGB3 (0.44) ITGB3ITGA2B

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
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
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed