SCHEMBL7357233

SCHEMBL7357233

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

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 3/20 0.35
ITGA2B P08514 3/20 0.35
SDCBP O00560 3/20 0.33
SDC2 P34741 3/20 0.33
MAP3K5 Q99683 1/20 0.33
MAPT P10636 1/20 0.33
RARB P10826 2/20 0.32
RARA P10276 1/20 0.32
ENPP2 Q13822 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL7358610 0.90 PLA2G4A (0.35) ITGB3ITGA2BSDCBPSDC2MAPT
SCHEMBL7356558 0.89 ITGB3 (0.43) ITGB3ITGA2BSDCBPSDC2MAPT
SCHEMBL7357027 0.88 ITGB3 (0.34) ITGB3ITGA2BSDCBPSDC2MAPT
SCHEMBL7359437 0.83 PPARG (0.37) SDCBPSDC2MAPTRARBRARA
SCHEMBL7357237 0.83 MAP3K5 (0.33) ITGB3ITGA2BMAP3K5RARBRARA
SCHEMBL7353747 0.82 ACACA (0.34) ITGB3ITGA2BMAP3K5RARBRARA
SCHEMBL7353334 0.82 ITGB3 (0.45) ITGB3ITGA2BMAP3K5ENPP2KDM4E
SCHEMBL7362403 0.81 CHRM5 (0.38) RARBRARAALDH1A1
SCHEMBL7354771 0.80 GALR3 (0.38) MAPTSMN1; SMN2HSD17B10
SCHEMBL7357036 0.79 ITGB3 (0.33) ITGB3ITGA2BMAP3K5RARBRARA

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
EP-0610334-B1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII B III A RECEPTOR GENENTECH INC (US) 1996-01-24 EP claimed
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 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