SCHEMBL5879538

SCHEMBL5879538

CC(=O)OC1c2ccccc2C(=O)N(CC(=O)NCc2ccc(Nc3nc4ccccc4[nH]3)cc2)c2ccccc21

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.73
ITGAV P06756 20/20 0.73

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
SCHEMBL5879616 0.93 ITGB3 (0.71) ITGB3ITGAV
SCHEMBL5879517 0.84 ITGB3 (0.72) ITGB3ITGAV
SCHEMBL5879791 0.84 ITGB3 (0.74) ITGB3ITGAV
SCHEMBL5879795 0.83 ITGB3 (0.73) ITGB3ITGAV
SCHEMBL5879526 0.81 ITGB3 (0.88) ITGB3ITGAV
SCHEMBL5879901 0.80 ITGB3 (0.73) ITGB3ITGAV
SCHEMBL5879645 0.80 ITGB3 (0.61) ITGB3ITGAV
SCHEMBL5879698 0.80 ITGB3 (0.71) ITGB3ITGAV
SCHEMBL5879582 0.80 ITGB3 (0.74) ITGB3ITGAV
SCHEMBL5879599 0.79 ITGB3 (0.85) ITGB3ITGAV

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7105508-B1 Integrin receptors antagonists ABBOTT GMBH & CO. KG (DE) 2006-09-12 US disclosed