SCHEMBL7287486

SCHEMBL7287486

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

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSK P43235 12/20 0.66
CTSL P07711 4/20 0.62
CTSB P07858 4/20 0.62
CTSS P25774 3/20 0.62
CAPN1 P07384 3/20 0.59
CAPN2 P17655 1/20 0.57

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
SCHEMBL7287480 1.00 CTSK (0.66) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL7165055 0.88 CTSK (0.66) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL29865964 0.87 CTSK (0.69) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL6495005 0.87 CTSK (0.69) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL9393894 0.86 CAPN1 (0.69) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL7293242 0.86 TACR1 (0.60) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL7293246 0.86 TACR1 (0.60) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL8583015 0.85 CTSK (0.66) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL30065522 0.85 CTSK (0.69) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL27493720 0.85 CTSK (0.69) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1994025581-A1 MODIFIED RECOMBINANT TISSUE PLASMINOGEN ACTIVATOR SOUTHERN SYDNEY AREA HEALTH SERVICE (AU) 1994-11-10 WO disclosed
EP-0263903-A1 Method for preparing specific inhibitors of virus-specified proteases E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-04-20 EP disclosed
EP-0263214-A1 Tetrapeptide methyl ketone inhibitors of viral proteases E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-04-13 EP disclosed
EP-0263202-A1 Inhibition of viral protease activity by peptide halomethyl ketones E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-04-13 EP disclosed
US-4652552-A ENZYME INHIBITORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-03-24 US disclosed
US-4644055-A HALOMETHYL KETONE OR METHYL KETONE COVALENTLY LINKED TO PEPTIDE SEQUENCE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-02-17 US disclosed
US-4636492-A ENZYME INHIBITORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-01-13 US disclosed