SCHEMBL7587326

SCHEMBL7587326

C[As](C)c1ccc(CNC(=O)NCCOc2ccc(C(=O)NC[C@H](NC(=O)OCc3ccccc3)C(=O)O)c(O)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 17/20 0.49
ITGAV P06756 8/20 0.49
ITGA2B P08514 9/20 0.46
EGLN2 Q96KS0 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
MAPT P10636 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL7033770 0.93 ITGB3 (0.53) ITGB3ITGAVITGA2BEGLN2EGLN1
SCHEMBL7038442 0.92 ITGB3 (0.51) ITGB3ITGAVITGA2BEGLN2EGLN1
SCHEMBL7030688 0.92 ITGB3 (0.51) ITGB3ITGAVITGA2BEGLN2EGLN1
SCHEMBL7032194 0.90 ITGB3 (0.51) ITGB3ITGAVITGA2BEGLN2EGLN1
SCHEMBL7037176 0.89 ITGB3 (0.49) ITGB3ITGAVITGA2BEGLN2EGLN1
SCHEMBL7032579 0.88 ITGB3 (0.49) ITGB3ITGAVITGA2BEGLN2EGLN1
SCHEMBL7035255 0.88 ITGB3 (0.46) ITGB3ITGAVITGA2BEGLN2EGLN1
SCHEMBL7036946 0.88 ITGB3 (0.49) ITGB3ITGAVITGA2BEGLN2EGLN1
SCHEMBL7032635 0.88 ITGB3 (0.49) ITGB3ITGAVITGA2BEGLN2EGLN1
SCHEMBL7034489 0.87 ITGB3 (0.47) ITGB3ITGAVITGA2BEGLN2EGLN1

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
WO-1999052879-A1 ACYLRESORCINOL DERIVATIVES AS SELECTIVE VITRONECTIN RECEPTOR INHIBITORS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-10-21 WO disclosed