SCHEMBL7754665

SCHEMBL7754665

CCOC(=O)[C@H](CNC(=O)CCNC(=O)c1ccc(C(=N)NC(=O)OC(C)(C)C)cc1)NS(=O)(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 14/20 0.46
ITGA2B P08514 13/20 0.46
PSMB8 P28062 3/20 0.42
PSMB5 P28074 3/20 0.42
USP2 O75604 1/20 0.39
ITGAV P06756 3/20 0.39

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
SCHEMBL7754621 0.93 ITGB3 (0.47) ITGB3ITGA2BPSMB8PSMB5USP2
SCHEMBL7752387 0.87 MMP2 (0.44) ITGB3ITGA2BPSMB8
SCHEMBL7748774 0.85 ITGB3 (0.59) ITGB3ITGA2BUSP2ITGAV
SCHEMBL27450344 0.82 USP2 (0.41) ITGB3ITGA2BPSMB8PSMB5USP2
SCHEMBL7753617 0.81 ITGB3 (0.51) ITGB3ITGA2BPSMB8PSMB5USP2
SCHEMBL7752664 0.80 SYK (0.47) ITGB3ITGA2BPSMB8ITGAV
SCHEMBL7753678 0.80 ITGB3 (0.60) ITGB3ITGA2BITGAV
SCHEMBL7752666 0.80 MMP2 (0.45) ITGB3ITGA2BPSMB8ITGAV
SCHEMBL7754751 0.79 MMP2 (0.42) ITGB3ITGA2BPSMB8PSMB5
SCHEMBL8902514 0.79 ITGAV (0.52) ITGB3ITGA2BPSMB8PSMB5USP2

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