SCHEMBL7359334

SCHEMBL7359334

CCCCc1ccc(C(C(=O)N2CCC(CC(=O)O)CC2)C(C)(C)NC(=O)c2ccc(C(=N)N)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.57
ITGA2B P08514 20/20 0.57

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
SCHEMBL7835723 0.89 ITGB3 (0.68) ITGB3ITGA2B
SCHEMBL7358265 0.88 ITGB3 (0.68) ITGB3ITGA2B
SCHEMBL7355902 0.87 ITGB3 (0.68) ITGB3ITGA2B
SCHEMBL7834876 0.87 ITGB3 (0.60) ITGB3ITGA2B
SCHEMBL7835429 0.85 ITGB3 (0.58) ITGB3ITGA2B
SCHEMBL7360429 0.85 ITGB3 (0.58) ITGB3ITGA2B
SCHEMBL7834890 0.83 ITGB3 (0.71) ITGB3ITGA2B
SCHEMBL7364391 0.83 ITGB3 (0.68) ITGB3ITGA2B
SCHEMBL7823669 0.82 ITGB3 (0.58) ITGB3ITGA2B
SCHEMBL7826128 0.82 ITGB3 (0.68) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0800516-B1 FIBRINOGEN RECEPTOR ANTAGONISTS HAVING SUBSTITUTED (b)-AMINO ACID RESIDUES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME NIPPON STEEL CORP (JP) 2001-09-19 EP disclosed
US-5866592-A Fibrinogen receptor antagonist and pharmaceutical compositions comprising the same NIPPON STEEL CORPORATION (JP) 1999-02-02 US disclosed
WO-1996020172-A1 FIBRINOGEN RECEPTOR ANTAGONISTS HAVING SUBSTITUTED β-AMINO ACID RESIDUES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME NIPPON STEEL CORPORATION (JP) 1996-07-04 WO disclosed