SCHEMBL7302930

SCHEMBL7302930

CC(C)CC(CNC(Cc1ccccc1)C(=O)CSCc1ccco1)NC(=O)OCC1CC=CCC1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PSMB1 P20618 2/20 0.36
PSMB5 P28074 2/20 0.36
PSMB2 P49721 2/20 0.36
ALDH1A1 P00352 4/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 2/20 0.35
USP2 O75604 1/20 0.34
MAPT P10636 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CAPN1 P07384 4/20 0.33
CTSK P43235 2/20 0.33
CTSS P25774 1/20 0.33
CTSL P07711 1/20 0.33
REN P00797 2/20 0.32

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
SCHEMBL7437241 0.91 ALDH1A1 (0.39) PSMB1PSMB5PSMB2ALDH1A1HPGD
SCHEMBL7302919 0.89 CAPN1 (0.43) PSMB1PSMB5PSMB2CAPN1CTSK
SCHEMBL7302936 0.89 CAPN1 (0.43) PSMB1PSMB5PSMB2CAPN1CTSK
SCHEMBL7302944 0.89 CAPN1 (0.43) PSMB1PSMB5PSMB2CAPN1CTSK
SCHEMBL7305805 0.85 MGLL (0.38) ALDH1A1HPGDSMN1; SMN2
SCHEMBL7438379 0.85 CYP1A2 (0.39) PSMB1PSMB5PSMB2ALDH1A1HPGD
SCHEMBL7307063 0.85 PSMB1 (0.48) PSMB1PSMB5PSMB2CAPN1CTSK
SCHEMBL7312640 0.85 PSMB1 (0.44) PSMB1PSMB5PSMB2ALDH1A1POLB
SCHEMBL7304423 0.85 PSMB1 (0.48) PSMB1PSMB5PSMB2CAPN1CTSK
SCHEMBL7303213 0.85 PSMB1 (0.41) PSMB1PSMB5PSMB2ALDH1A1POLB

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