SCHEMBL7305705

SCHEMBL7305705

CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C(=O)CSC

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.61
CTSL P07711 4/20 0.58
CTSB P07858 3/20 0.58
CTSS P25774 3/20 0.57
CAPN1 P07384 3/20 0.55
CAPN2 P17655 1/20 0.55
MMP3 P08254 1/20 0.54

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
SCHEMBL7305719 1.00 CTSK (0.61) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL7312669 0.91 CTSK (0.67) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL7312656 0.91 CTSK (0.67) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL7304260 0.90 CTSL (0.68) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL7302072 0.90 CTSK (0.61) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL7304278 0.90 CTSL (0.68) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL7302061 0.90 CTSK (0.61) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL9600765 0.88 CTSK (0.63) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL9641495 0.88 CTSK (0.63) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL7306858 0.88 CAPN1 (0.67) CTSKCTSLCTSBCTSSCAPN1

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