SCHEMBL7303351

SCHEMBL7303351

CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)CSCc1ccco1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
REN P00797 11/20 0.57
CTSS P25774 3/20 0.49
CTSK P43235 2/20 0.49
ACE P12821 1/20 0.47
CTSL P07711 1/20 0.46
CTSB P07858 1/20 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
SCHEMBL7303359 1.00 REN (0.57) RENCTSSCTSKACECTSL
SCHEMBL7340534 0.92 ACE (0.54) RENCTSSCTSKACECTSL
SCHEMBL7340544 0.92 ACE (0.54) RENCTSSCTSKACECTSL
SCHEMBL7304416 0.89 CAPN1 (0.57) CTSSCTSKCTSLCTSB
SCHEMBL7312633 0.89 CAPN1 (0.52) CTSKCTSLCTSB
SCHEMBL7303217 0.89 CAPN1 (0.48) RENCTSKCTSLCTSB
SCHEMBL7307053 0.89 CAPN1 (0.57) CTSSCTSKCTSLCTSB
SCHEMBL7430388 0.89 CAPN1 (0.48) RENCTSKCTSLCTSB
SCHEMBL7304428 0.89 CAPN1 (0.57) CTSSCTSKCTSLCTSB
SCHEMBL7303357 0.86 CTSS (0.46) RENCTSSCTSKACECTSL

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-0525420-B1 Pseudopeptides and dipeptides characterised by a substituted methyl ketone moiety at the C-terminus as thiol protease inhibitors MITSUBISHI CHEM CORP (JP) 1999-05-12 EP disclosed
US-5834508-A PROTEASE ENZYME INHIBITORS; MUSCLE DISORDERS MITSUBISHI CHEMICAL CORPORATION (JP) 1998-11-10 US disclosed
US-5639783-A POTENT PROTEASE INHIBITOR FOR TREATING MUSCULAR, NERVOUS SYSTEM DISEASES MITSUBISHI CHEMICAL CORPORATION (JP) 1997-06-17 US disclosed
EP-0525420-A1 Pseudopeptides and dipeptides characterised by a substituted methyl ketone moiety at the C-terminus as thiol protease inhibitors Mitsubishi Chemical Corporation (JP) 1993-02-03 EP disclosed