SCHEMBL7330253

SCHEMBL7330253

CCOC(=O)CCN1CC(=O)N(C)c2ccc(NC(=O)c3cccc(C(=N)N)c3)cc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 9/20 0.49
ITGA2B P08514 9/20 0.49
PLAU P00749 3/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
KHK P50053 1/20 0.40
F10 P00742 3/20 0.39
F2 P00734 2/20 0.39
PRSS1 P07477 1/20 0.38
ITGA2 P17301 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL7326457 0.93 ITGB3 (0.56) ITGB3ITGA2BF10F2ITGA2
Acetic Acid SCHEMBL7331206 0.90 ITGB3 (0.56) ITGB3ITGA2BF10F2ITGA2
SCHEMBL9317817 0.90 ITGB3 (0.51) ITGB3ITGA2BF10F2PRSS1
Acetic Acid SCHEMBL7334578 0.87 ITGB3 (0.60) ITGB3ITGA2BMEN1KMT2AKHK
SCHEMBL7332811 0.86 CNR1 (0.42) ITGB3ITGA2BMEN1KMT2AITGA2
SCHEMBL9317712 0.85 ITGB3 (0.57) ITGB3ITGA2BF10F2
Acetic Acid SCHEMBL9317585 0.83 ITGB3 (0.57) ITGB3ITGA2BF10F2
SCHEMBL7331720 0.83 ITGB3 (0.67) ITGB3ITGA2BF10F2PRSS1
SCHEMBL7323790 0.82 ITGB3 (0.45) ITGB3ITGA2BF10F2ITGA2
SCHEMBL7328382 0.82 ITGB3 (0.47) ITGB3ITGA2BMEN1KMT2AITGA2

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