SCHEMBL7754726

SCHEMBL7754726

Cc1ccccc1S(=O)(=O)N[C@@H](CNC(=O)CCNC(=O)c1ccc(C(=N)N)cc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ITGAV P06756 7/20 0.67
ITGB3 P05106 12/20 0.58
ITGA2B P08514 12/20 0.58
ITGA2 P17301 1/20 0.57
OPRK1 P41145 1/20 0.44

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
SCHEMBL7753251 0.90 ITGB3 (0.59) ITGAVITGB3ITGA2BITGA2
SCHEMBL7753440 0.88 ITGB3 (0.62) ITGAVITGB3ITGA2B
SCHEMBL8198202 0.88 ITGB3 (0.62) ITGAVITGB3ITGA2B
SCHEMBL27461966 0.87 ITGB3 (0.73) ITGAVITGB3ITGA2B
SCHEMBL7752361 0.87 ITGB3 (0.73) ITGAVITGB3ITGA2B
SCHEMBL7752629 0.87 ITGB3 (0.73) ITGAVITGB3ITGA2B
SCHEMBL7752449 0.86 ITGB3 (0.55) ITGAVITGB3ITGA2B
SCHEMBL7754652 0.85 ITGB3 (0.55) ITGAVITGB3ITGA2B
SCHEMBL7748743 0.85 ITGAV (0.56) ITGAVITGB3ITGA2B
SCHEMBL7752365 0.85 ITGB3 (0.62) 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-0725059-B1 2,3-DIAMINOPROPIONIC ACID DERIVATIVE SUMITOMO PHARMA (JP) 2001-01-17 EP disclosed
US-6048854-A ANTICOAGULANTS; ANTICANCER AGENT; WOUND HEALING AGENTS;BONE DISORDERS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-04-11 US disclosed
US-5707994-A USEFUL AS A PLATELET AGGREGATION INHIBITOR, CANCER METASTASIS INHIBITOR, WOUND HEALING AGENT OR A BONE RESORPTION INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-01-13 US disclosed