SCHEMBL7979235

SCHEMBL7979235

O=C(NC(CNC(=O)C1CC(CCCCNc2ncc[nH]2)=NO1)C(=O)O)OCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.67
ITGA2B P08514 15/20 0.67
ITGAV P06756 17/20 0.66

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
SCHEMBL7979129 0.95 ITGB3 (0.65) ITGB3ITGA2BITGAV
SCHEMBL7980601 0.85 ITGB3 (0.67) ITGB3ITGA2BITGAV
SCHEMBL7406830 0.83 ITGB3 (0.66) ITGB3ITGA2BITGAV
SCHEMBL7982740 0.83 ITGB3 (0.67) ITGB3ITGA2BITGAV
SCHEMBL7979245 0.82 ITGB3 (0.53) ITGB3ITGA2BITGAV
SCHEMBL7404994 0.81 ITGB3 (0.68) ITGB3ITGA2BITGAV
SCHEMBL7402861 0.81 ITGB3 (0.67) ITGB3ITGA2BITGAV
SCHEMBL7405502 0.80 ITGB3 (0.74) ITGB3ITGA2BITGAV
SCHEMBL7979135 0.80 ITGB3 (0.51) ITGB3ITGA2BITGAV
SCHEMBL7406112 0.80 ITGB3 (0.65) ITGB3ITGA2BITGAV

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-6214834-B1 ANGIOGENESIS INHIBITORS; ANTIINFLAMMATORY AGENTS; ANTICANCER AGENTS DUPONT PHARMACEUTICALS COMPANY 2001-04-10 US disclosed