SCHEMBL7310207

SCHEMBL7310207

CCCCC(NC(=O)C(CC(C)C)NC(=O)OCc1ccccn1)C(=O)CSCc1ccco1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSL P07711 6/20 0.48
CTSB P07858 6/20 0.48
REN P00797 1/20 0.44
CTSK P43235 6/20 0.40
CTSS P25774 2/20 0.39
MMP3 P08254 1/20 0.38
CAPN1 P07384 1/20 0.38

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
SCHEMBL7310190 1.00 CTSL (0.48) CTSLCTSBRENCTSKCTSS
SCHEMBL7310618 0.89 CTSL (0.48) CTSLCTSBCTSKCAPN1
SCHEMBL7310625 0.89 CTSL (0.48) CTSLCTSBCTSKCAPN1
SCHEMBL7303685 0.88 CTSL (0.54) CTSLCTSBCTSKCTSSMMP3
SCHEMBL7303674 0.88 CTSL (0.54) CTSLCTSBCTSKCTSSMMP3
SCHEMBL7310196 0.88 CTSL (0.40) CTSLCTSBRENCTSKCTSS
SCHEMBL7309637 0.85 CTSL (0.47) CTSLCTSBCTSKCTSSMMP3
SCHEMBL7309645 0.85 CTSL (0.47) CTSLCTSBCTSKCTSSMMP3
SCHEMBL7305495 0.85 CTSL (0.58) CTSLCTSBRENCTSKCTSS
SCHEMBL7305486 0.85 CTSL (0.58) CTSLCTSBRENCTSKCTSS

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