SCHEMBL7328497

SCHEMBL7328497

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

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.56
CTSS P25774 3/20 0.54
CTSL P07711 2/20 0.53
CTSB P07858 1/20 0.53
CAPN1 P07384 1/20 0.53
BIRC2 Q13490 3/20 0.51
REN P00797 2/20 0.48
PSMB5 P28074 1/20 0.48
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PDF Q9HBH1 1/20 0.43

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
SCHEMBL3826120 0.92 CTSK (0.55) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL1176795 0.88 CTSL (0.62) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL1026994 0.88 CTSL (0.62) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL1026997 0.88 CTSL (0.62) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL29508370 0.88 CTSK (0.65) CTSKCTSS
SCHEMBL8137516 0.88 CTSK (0.65) CTSKCTSS
SCHEMBL245704 0.88 CTSK (0.65) CTSKCTSS
SCHEMBL11169993 0.87 CTSK (0.55) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL17306034 0.87 CTSK (0.55) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL2734195 0.87 CTSK (0.59) CTSKCTSSBIRC2RENPDF

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
US-5510531-A ANTIINFLAMMATROY AGENTS, MUSCULAR DISORDERS SUNTORY LIMITED (JP) 1996-04-23 US disclosed
EP-0393457-B1 Proteinase inhibitor SUNTORY LTD (JP) 1994-07-06 EP disclosed
US-5081284-A N-Oxomethyl-Substituted Peptide SUNTORY LIMITED (JP) 1992-01-14 US disclosed
EP-0393457-A1 Proteinase inhibitor SUNTORY LIMITED (JP) 1990-10-24 EP disclosed