SCHEMBL7333455

SCHEMBL7333455

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

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 7/20 0.45
ITGA2B P08514 7/20 0.45
CYP3A4 P08684 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NPY4R P50391 2/20 0.31
LIPG Q9Y5X9 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
SCHEMBL7323748 0.92 ITGB3 (0.37) ITGB3ITGA2BNPY4R
SCHEMBL7323437 0.90 ITGB3 (0.45) ITGB3ITGA2BCYP3A4
SCHEMBL7334284 0.90 ITGB3 (0.39) ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7333452 0.89 ITGB3 (0.54) ITGB3ITGA2BNPY4RLIPG
SCHEMBL7333911 0.89 ITGB3 (0.37) ITGB3ITGA2BNPY4R
SCHEMBL7330483 0.89 ITGB3 (0.36) ITGB3ITGA2BLIPG
SCHEMBL7329192 0.88 ITGB3 (0.44) ITGB3ITGA2B
SCHEMBL7330299 0.87 ITGB3 (0.45) ITGB3ITGA2B
SCHEMBL7331731 0.86 ITGB3 (0.42) ITGB3ITGA2BCYP3A4TDP1LIPG
SCHEMBL7327955 0.85 ITGB3 (0.53) 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 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