SCHEMBL7300556

SCHEMBL7300556

CC(C)CC(NC(=O)NCc1ccccc1)C(=O)NC(Cc1ccccc1)C(=O)CSCc1ccco1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 6/20 0.60
PSMB1 P20618 5/20 0.60
PSMB2 P49721 5/20 0.60
ANPEP P15144 5/20 0.54
HTRA1 Q92743 1/20 0.48
MMP8 P22894 1/20 0.47
ALDH1A1 P00352 1/20 0.47
ATM Q13315 1/20 0.45
MMP1 P03956 1/20 0.45
FCER2 P06734 1/20 0.45
KLKB1 P03952 1/20 0.44

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
SCHEMBL7300546 1.00 PSMB5 (0.60) PSMB5PSMB1PSMB2ANPEPHTRA1
SCHEMBL7300779 0.87 REN (0.51) PSMB5PSMB1PSMB2
SCHEMBL7300785 0.87 REN (0.51) PSMB5PSMB1PSMB2
SCHEMBL7300553 0.86 PSMB5 (0.51) PSMB5PSMB1PSMB2ANPEPMMP8
SCHEMBL7301724 0.86 PSMB5 (0.47) PSMB5PSMB1PSMB2ANPEP
SCHEMBL7301741 0.86 PSMB5 (0.47) PSMB5PSMB1PSMB2ANPEP
SCHEMBL7301731 0.86 PSMB5 (0.47) PSMB5PSMB1PSMB2ANPEP
SCHEMBL7429195 0.85 TSHR (0.46) PSMB5PSMB1PSMB2FCER2
SCHEMBL7430388 0.85 CAPN1 (0.48) PSMB5PSMB1PSMB2HTRA1
SCHEMBL7303217 0.85 CAPN1 (0.48) PSMB5PSMB1PSMB2HTRA1

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
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-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