SCHEMBL7753440

SCHEMBL7753440

N=C(N)c1ccc(C(=O)NCCC(=O)NC[C@H](NS(=O)(=O)c2cccc3ccccc23)C(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 11/20 0.62
ITGA2B P08514 11/20 0.62
ITGAV P06756 8/20 0.50
F10 P00742 2/20 0.47
PLG P00747 1/20 0.47

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
SCHEMBL8198202 1.00 ITGB3 (0.62) ITGB3ITGA2BITGAVF10PLG
SCHEMBL7753251 0.89 ITGB3 (0.59) ITGB3ITGA2BITGAV
SCHEMBL7754726 0.88 ITGAV (0.67) ITGB3ITGA2BITGAV
SCHEMBL7752361 0.86 ITGB3 (0.73) ITGB3ITGA2BITGAV
SCHEMBL7752629 0.86 ITGB3 (0.73) ITGB3ITGA2BITGAV
SCHEMBL27461966 0.86 ITGB3 (0.73) ITGB3ITGA2BITGAV
SCHEMBL7752449 0.85 ITGB3 (0.55) ITGB3ITGA2BITGAV
SCHEMBL8185091 0.85 ITGB3 (0.55) ITGB3ITGA2BITGAVF10PLG
SCHEMBL7754652 0.85 ITGB3 (0.55) ITGB3ITGA2BITGAV
SCHEMBL7753614 0.85 ITGB3 (0.51) ITGB3ITGA2BITGAVF10PLG

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 4 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
EP-0725059-A1 2,3-DIAMINOPROPIONIC ACID DERIVATIVE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-08-07 EP disclosed