SCHEMBL7305029

SCHEMBL7305029

CSCC(=O)C(Cc1ccccc1)NCC(CC(C)C)NC(=O)CCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 9/20 0.44
CTSG P08311 2/20 0.44
CMA1 P23946 2/20 0.44
PSMB1 P20618 1/20 0.43
PSMB2 P49721 1/20 0.43
ACE P12821 1/20 0.42

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
SCHEMBL7306959 0.87 PAM (0.47) PSMB5ACE
SCHEMBL7301739 0.83 ALDH1A1 (0.43) PSMB5CTSGCMA1PSMB1PSMB2
SCHEMBL7305034 0.83 PSMB5 (0.53) PSMB5CTSGCMA1PSMB1PSMB2
SCHEMBL7305024 0.83 PSMB5 (0.53) PSMB5CTSGCMA1PSMB1PSMB2
SCHEMBL7306865 0.82 PSMB1 (0.56) PSMB5PSMB1PSMB2
SCHEMBL7311946 0.82 ATM (0.52) ACE
SCHEMBL7300595 0.79 PSMB1 (0.52) PSMB5PSMB1PSMB2
SCHEMBL7431424 0.79 CTSL (0.48)
SCHEMBL7432833 0.79 GGT1 (0.47) PSMB5ACE
SCHEMBL7312132 0.78 CTSG (0.43) PSMB5CTSGCMA1PSMB1PSMB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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