SCHEMBL7306550

SCHEMBL7306550

CSCC(=O)C(COCc1ccccc1)NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 12/20 0.66
CTSL P07711 6/20 0.66
CTSS P25774 4/20 0.66
CTSB P07858 3/20 0.58
CAPN1 P07384 2/20 0.56

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
SCHEMBL7306536 1.00 CTSK (0.66) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL7312669 0.93 CTSK (0.67) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL7312656 0.93 CTSK (0.67) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL7306858 0.90 CAPN1 (0.67) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL7306872 0.90 CAPN1 (0.67) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL7304260 0.88 CTSL (0.68) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL7302072 0.88 CTSK (0.61) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL7302061 0.88 CTSK (0.61) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL7304278 0.88 CTSL (0.68) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL2910145 0.87 CTSK (0.73) CTSKCTSLCTSSCTSBCAPN1

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
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