SCHEMBL7306956

SCHEMBL7306956

CSCC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(C)=O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 3/20 0.56
CPA2 P48052 3/20 0.56
CPA4 Q9UI42 3/20 0.56
CPB1 P15086 1/20 0.56
ACE2 Q9BYF1 1/20 0.56
ALDH1A1 P00352 1/20 0.54
REN P00797 3/20 0.53
PAM P19021 1/20 0.52
MME P08473 2/20 0.51
PSMB5 P28074 2/20 0.49
GNPAT O15228 1/20 0.49

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
SCHEMBL7306969 1.00 CPA1 (0.56) CPA1CPA2CPA4CPB1ACE2
SCHEMBL7305024 0.86 PSMB5 (0.53) RENMMEPSMB5
SCHEMBL7305034 0.86 PSMB5 (0.53) RENMMEPSMB5
SCHEMBL7306858 0.85 CAPN1 (0.67)
SCHEMBL7306872 0.85 CAPN1 (0.67)
SCHEMBL30777486 0.85 MME (0.65) CPA1CPA2CPA4CPB1ACE2
SCHEMBL15692334 0.85 MME (0.65) CPA1CPA2CPA4CPB1ACE2
SCHEMBL17210510 0.85 BACE1 (0.50) CPA1CPA2CPA4CPB1ACE2
SCHEMBL7311952 0.85 REN (0.67) REN
SCHEMBL7311940 0.85 REN (0.67) REN

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