SCHEMBL7327280

SCHEMBL7327280

N=C(N)NCCCCCc1ccc2c(c1)C(=O)N(C(CC(=O)OC(=O)C(F)(F)F)c1ccccc1)CC(=O)N2Cc1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 5/20 0.32
ITGA2B P08514 5/20 0.32
LIPG Q9Y5X9 1/20 0.31
TP53 P04637 2/20 0.31
NAMPT P43490 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
POLB P06746 1/20 0.30
ASAH1 Q13510 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL7330483 0.92 ITGB3 (0.36) ITGB3ITGA2BLIPGKMT2APOLB
SCHEMBL7329123 0.91 HDAC3 (0.36) ITGB3ITGA2BTP53MEN1KMT2A
SCHEMBL7334284 0.90 ITGB3 (0.39) ITGB3ITGA2BTP53MEN1KMT2A
Trifluoroacetic Acid SCHEMBL7327277 0.90 MEN1 (0.37) ITGB3ITGA2BLIPGNAMPTMEN1
SCHEMBL7324967 0.90 ITGB3 (0.32) ITGB3ITGA2BMEN1KMT2A
SCHEMBL7332009 0.90 MEN1 (0.33) ITGB3ITGA2BTP53MEN1KMT2A
SCHEMBL7331609 0.89 ITGB3 (0.33) ITGB3ITGA2BTP53MEN1KMT2A
SCHEMBL7331785 0.89 ITGB3 (0.32) ITGB3ITGA2BMEN1KMT2A
SCHEMBL8842860 0.88 ITGB3 (0.33) ITGB3ITGA2BTP53
SCHEMBL7324693 0.87 ITGB3 (0.37) 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