SCHEMBL7309219

SCHEMBL7309219

CC(C)CC(CNC(Cc1ccccc1)C(=O)CSc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PSMB1 P20618 1/20 0.54
PSMB5 P28074 1/20 0.54
PSMB2 P49721 1/20 0.54
CTSK P43235 7/20 0.51
CTSL P07711 5/20 0.51
CASP1 P29466 1/20 0.50
CTSS P25774 3/20 0.48
CTSB P07858 2/20 0.48
CAPN1 P07384 2/20 0.48
CTRB1 P17538 2/20 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
SCHEMBL7306865 0.90 PSMB1 (0.56) PSMB1PSMB5PSMB2CTSKCTSL
SCHEMBL7309277 0.88 PSMB1 (0.54) PSMB1PSMB5PSMB2CTSKCTSL
SCHEMBL7300595 0.87 PSMB1 (0.52) PSMB1PSMB5PSMB2CTSKCTSL
SCHEMBL7312782 0.86 PSMB1 (0.57) PSMB1PSMB5PSMB2CTSKCTSL
SCHEMBL7310528 0.86 PSMB1 (0.52) PSMB1PSMB5PSMB2CTSKCTSL
SCHEMBL7304167 0.85 PSMB1 (0.51) PSMB1PSMB5PSMB2CTSKCTSL
SCHEMBL7304336 0.85 PSMB1 (0.53) PSMB1PSMB5PSMB2CTSKCTSL
SCHEMBL7315463 0.85 PSMB1 (0.56) PSMB1PSMB5PSMB2CTSKCTSL
SCHEMBL7314633 0.84 PSMB1 (0.50) PSMB1PSMB5PSMB2CTSKCTSL
SCHEMBL7314150 0.84 CTSK (0.56) PSMB1PSMB5PSMB2CTSKCTSL

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