SCHEMBL7310295

SCHEMBL7310295

CC(C)CC(NC(=O)OCc1cccnc1)C(=O)NC(Cc1ccccc1)C(=O)CSCc1ccco1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSL P07711 5/20 0.64
CTSB P07858 4/20 0.64
CAPN1 P07384 2/20 0.49
CTSK P43235 3/20 0.46
HTRA1 Q92743 1/20 0.45

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
SCHEMBL7310284 1.00 CTSL (0.64) CTSLCTSBCAPN1CTSKHTRA1
SCHEMBL7303786 0.92 CTSL (0.55) CTSLCTSBCAPN1CTSKHTRA1
SCHEMBL7303773 0.92 CTSL (0.55) CTSLCTSBCAPN1CTSKHTRA1
SCHEMBL7307053 0.92 CAPN1 (0.57) CTSLCTSBCAPN1CTSKHTRA1
SCHEMBL7304416 0.92 CAPN1 (0.57) CTSLCTSBCAPN1CTSKHTRA1
SCHEMBL7304428 0.92 CAPN1 (0.57) CTSLCTSBCAPN1CTSKHTRA1
SCHEMBL7312633 0.90 CAPN1 (0.52) CTSLCTSBCAPN1CTSKHTRA1
SCHEMBL7310291 0.88 CTSL (0.51) CTSLCTSBCTSK
SCHEMBL7300643 0.88 CTSK (0.56) CTSLCTSBCAPN1CTSK
SCHEMBL7300633 0.88 CTSK (0.56) CTSLCTSBCAPN1CTSK

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