SCHEMBL7354080

SCHEMBL7354080

CC(CN1CC(=O)N(Cc2ccc(Cl)cc2)c2ccc(OCCC3CCNCC3)cc2C1=O)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 11/20 0.45
ITGA2B P08514 11/20 0.45
P2RX3 P56373 6/20 0.37
ACACB O00763 2/20 0.37
MCHR1 Q99705 1/20 0.35

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
SCHEMBL7358023 0.87 ITGB3 (0.49) ITGB3ITGA2BMCHR1
SCHEMBL7357974 0.86 ITGB3 (0.50) ITGB3ITGA2B
SCHEMBL7354066 0.85 ITGB3 (0.42) ITGB3ITGA2BACACB
SCHEMBL7353725 0.85 ITGB3 (0.43) ITGB3ITGA2BP2RX3
SCHEMBL7354072 0.84 ITGB3 (0.44) ITGB3ITGA2BACACB
SCHEMBL7355548 0.83 ITGB3 (0.41) ITGB3ITGA2BP2RX3
SCHEMBL7358870 0.81 ITGB3 (0.46) ITGB3ITGA2B
SCHEMBL7357407 0.81 ITGB3 (0.41) ITGB3ITGA2BACACB
SCHEMBL7359446 0.80 P2RX3 (0.40) P2RX3
SCHEMBL7361348 0.79 ITGB3 (0.50) 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
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
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