SCHEMBL7748737

SCHEMBL7748737

CCc1ccc(S(=O)(=O)N[C@@H](CNC(=O)CCNC(=O)c2ccc(C(=N)N)cc2)C(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 17/20 0.62
ITGA2B P08514 17/20 0.62
F2 P00734 3/20 0.48
TMPRSS6 Q8IU80 3/20 0.48
ITGAV P06756 2/20 0.46

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
SCHEMBL7752365 0.90 ITGB3 (0.62) ITGB3ITGA2B
SCHEMBL7754731 0.90 ITGB3 (0.51) ITGB3ITGA2BF2TMPRSS6
SCHEMBL7752629 0.89 ITGB3 (0.73) ITGB3ITGA2BITGAV
SCHEMBL27461966 0.89 ITGB3 (0.73) ITGB3ITGA2BITGAV
SCHEMBL7752361 0.89 ITGB3 (0.73) ITGB3ITGA2BITGAV
SCHEMBL7752313 0.89 ITGB3 (0.62) ITGB3ITGA2BF2TMPRSS6ITGAV
SCHEMBL7754743 0.88 ITGB3 (0.53) ITGB3ITGA2BF2TMPRSS6
SCHEMBL7752735 0.88 ITGB3 (0.59) ITGB3ITGA2BITGAV
SCHEMBL8185170 0.87 ITGB3 (0.54) ITGB3ITGA2BF2TMPRSS6ITGAV
SCHEMBL7753629 0.85 ITGB3 (0.47) ITGB3ITGA2BF2TMPRSS6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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
EP-0725059-A1 2,3-DIAMINOPROPIONIC ACID DERIVATIVE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-08-07 EP disclosed