SCHEMBL7356558

SCHEMBL7356558

CCC(C(=O)O)N1CC(=O)N(C)c2ccc(-c3ccc(OCCN)cc3)cc2C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 5/20 0.43
ITGA2B P08514 5/20 0.43
SDCBP O00560 2/20 0.34
SDC2 P34741 2/20 0.34
NR1H2 P55055 2/20 0.34
NR1H3 Q13133 2/20 0.34
HRH3 Q9Y5N1 3/20 0.33
MAPK1 P28482 2/20 0.33
MAPT P10636 2/20 0.33
RARA P10276 1/20 0.33
RARB P10826 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
CDC25A P30304 1/20 0.32
CDC25B P30305 1/20 0.32
CDC25C P30307 1/20 0.32

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
SCHEMBL7357233 0.89 ITGB3 (0.35) ITGB3ITGA2BSDCBPSDC2MAPK1
SCHEMBL7357027 0.87 ITGB3 (0.34) ITGB3ITGA2BSDCBPSDC2MAPK1
SCHEMBL7358610 0.86 PLA2G4A (0.35) ITGB3ITGA2BSDCBPSDC2HRH3
SCHEMBL7359437 0.84 PPARG (0.37) SDCBPSDC2MAPTRARARARB
SCHEMBL7362403 0.82 CHRM5 (0.38) HRH3RARARARBALDH1A1L3MBTL1
SCHEMBL7356570 0.82 ITGB3 (0.42) ITGB3ITGA2BNR1H2NR1H3HRH3
SCHEMBL7354771 0.81 GALR3 (0.38) MAPTSMN1; SMN2HSD17B10
SCHEMBL7356563 0.81 ITGB3 (0.38) ITGB3ITGA2BNR1H2NR1H3HRH3
SCHEMBL7359698 0.81 ITGB3 (0.57) ITGB3ITGA2BNR1H2NR1H3MAPK1
SCHEMBL7363866 0.80 ITGB3 (0.37) ITGB3ITGA2BNR1H2NR1H3HRH3

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
EP-0610334-B1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII B III A RECEPTOR GENENTECH INC (US) 1996-01-24 EP claimed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO claimed
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