SCHEMBL7175459

SCHEMBL7175459

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

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSK P43235 10/20 0.57
CTSB P07858 4/20 0.57
CTSS P25774 7/20 0.56
CTSL P07711 7/20 0.56
CASP3 P42574 1/20 0.53
CA2 P00918 1/20 0.51
CA5A P35218 1/20 0.51

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
SCHEMBL2147583 0.89 CTSK (0.61) CTSKCTSBCTSSCTSL
SCHEMBL4660369 0.89 CTSK (0.61) CTSKCTSBCTSSCTSL
SCHEMBL3959352 0.89 CTSK (0.61) CTSKCTSBCTSSCTSL
SCHEMBL10610800 0.88 CTSK (0.63) CTSKCTSBCTSSCTSL
SCHEMBL10610794 0.88 CTSK (0.63) CTSKCTSBCTSSCTSL
SCHEMBL11209608 0.87 CTSK (0.71) CTSKCTSBCTSSCTSL
SCHEMBL6014223 0.87 CTSK (0.71) CTSKCTSBCTSSCTSL
SCHEMBL25176537 0.84 CASP3 (0.57) CTSKCTSBCTSSCTSLCASP3
SCHEMBL15531881 0.84 CTSL (0.53) CTSKCTSBCTSSCTSLCASP3
SCHEMBL7181654 0.84 CTSS (0.57) CTSKCTSBCTSSCTSLCASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030165743-A1 GEL ELECTROLYTE, CELL AND ELECTROCHROMIC ELEMENT CANON KABUSHIKI KAISHA (JP) 2003-09-04 US disclosed
EP-0996029-A2 Gel electrolyte, cell and electrochromic element CANON KABUSHIKI KAISHA (JP) 2000-04-26 EP disclosed