SCHEMBL7367376

SCHEMBL7367376

CN1Cc2cc(C(=O)NCCc3cc4ccccc4n3C)ccc2NC(CC(=O)O)C1=O

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 18/20 0.69
ITGAV P06756 18/20 0.69
ITGA2B P08514 13/20 0.67

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
SCHEMBL7539104 0.92 ITGB3 (0.71) ITGB3ITGAVITGA2B
SCHEMBL7543841 0.82 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL7333550 0.81 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL8359098 0.80 ITGB3 (0.69) ITGB3ITGAVITGA2B
SCHEMBL8180742 0.79 ITGB3 (0.77) ITGB3ITGAVITGA2B
SCHEMBL7367179 0.78 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL7398023 0.78 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL8170992 0.78 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL8468835 0.76 ITGB3 (0.70) ITGB3ITGAVITGA2B
SCHEMBL8468848 0.76 ITGB3 (0.70) ITGB3ITGAVITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0767792-A4 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2002-11-20 EP disclosed
EP-0767792-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-04-16 EP disclosed
WO-1996000730-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1996-01-11 WO disclosed