SCHEMBL7752529

SCHEMBL7752529

CC(C)(C)OC(=O)NC[C@H](NC(=O)OCc1ccccc1)C(=O)OC1CCc2cc(O)ccc21

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.52
KLK7 P49862 4/20 0.43
KLK5 Q9Y337 3/20 0.43
CACNA1B Q00975 2/20 0.41
CTSK P43235 6/20 0.41
CTSS P25774 4/20 0.40
CTSL P07711 2/20 0.40
CTSB P07858 2/20 0.40
PPARA Q07869 1/20 0.39
CASP1 P29466 1/20 0.39
SCN9A Q15858 1/20 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
SCHEMBL7753603 0.84 NPY5R (0.39) SYK
SCHEMBL29521579 0.82 SYK (0.63) SYKKLK7KLK5CACNA1BCTSK
SCHEMBL22975065 0.79 SYK (0.60) SYKKLK7KLK5CACNA1BCTSK
SCHEMBL22975064 0.79 SYK (0.60) SYKKLK7KLK5CACNA1BCTSK
SCHEMBL3897638 0.78 SYK (0.72) SYKCTSKCTSSCTSLCTSB
SCHEMBL30460045 0.78 SYK (0.72) SYKCTSKCTSSCTSLCTSB
SCHEMBL14496968 0.77 SYK (0.71) SYKKLK5CTSKCTSSCTSL
SCHEMBL479093 0.77 SYK (0.71) SYKKLK5CTSKCTSSCTSL
SCHEMBL479092 0.77 SYK (0.71) SYKKLK5CTSKCTSSCTSL
SCHEMBL615359 0.76 SYK (0.72) SYKCTSKCTSSCTSLCTSB

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