SCHEMBL7319919

SCHEMBL7319919

CCOC(=O)CC(C)N1CC(=O)N(C)c2ccc(I)cc2C1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 5/20 0.48
ITGA2B P08514 5/20 0.48
CASP3 P42574 1/20 0.40
ALDH1A1 P00352 2/20 0.35
GABRA1 P14867 8/20 0.35
GABRG2 P18507 8/20 0.35
GABRB3 P28472 8/20 0.35
GABRA5 P31644 8/20 0.35
GABRA3 P34903 8/20 0.35
GABRA2 P47869 8/20 0.35
GABRA6 Q16445 6/20 0.35
DPP7 Q9UHL4 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 1/20 0.34
RAB9A P51151 1/20 0.34
MDM2 Q00987 1/20 0.34
GABRB2 P47870 4/20 0.33
GABRA4 P48169 2/20 0.33
GABRP O00591 1/20 0.33

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
SCHEMBL7325524 0.89 ITGB3 (0.38) ITGB3ITGA2BCASP3ALDH1A1GABRA1
SCHEMBL7322279 0.85 MEN1 (0.40) ITGB3ITGA2BCASP3ALDH1A1MEN1
SCHEMBL7330180 0.85 KMT2A (0.38) ITGB3ITGA2BCASP3ALDH1A1MEN1
SCHEMBL7328993 0.84 MAPT (0.39) ITGB3ITGA2BALDH1A1KMT2ALMNA
SCHEMBL7330261 0.80 ITGB3 (0.55) ITGB3ITGA2BCASP3GABRA1GABRG2
SCHEMBL7331776 0.80 ITGB3 (0.57) ITGB3ITGA2BCASP3ALDH1A1GABRA1
SCHEMBL7325381 0.80 ITGB3 (0.46) ITGB3ITGA2BCASP3ALDH1A1GABRA1
SCHEMBL7321185 0.80 ITGB3 (0.52) ITGB3ITGA2BGABRA1GABRG2GABRB3
SCHEMBL7333147 0.80 ITGB3 (0.44) ITGB3ITGA2BALDH1A1GABRA1GABRG2
SCHEMBL7330255 0.78 ITGB3 (0.45) ITGB3ITGA2BCASP3GABRA1GABRG2

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 9 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
US-5403836-A Anticoagulants GENENTECH, INC. (US) 1995-04-04 US disclosed
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 EP disclosed
US-5250679-A Nonpeptidyl platelet aggregation inhibitors having specificity for the GPIIb III.sub. receptor GENENTECH, INC. (US) 1993-10-05 US disclosed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed