SCHEMBL7310595

SCHEMBL7310595

CCCCC(NC(=O)C(CC(C)C)NC(=O)c1cccc(F)c1)C(=O)CSCc1ccco1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 5/20 0.48
HPGD P15428 1/20 0.43
CTSS P25774 2/20 0.39
CTSK P43235 2/20 0.39
POLB P06746 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
USP2 O75604 2/20 0.38
MAPK1 P28482 2/20 0.38
TSHR P16473 1/20 0.38
CNR2 P34972 1/20 0.37
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CCNA1 P78396 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GAA P10253 1/20 0.36
NPC1 O15118 1/20 0.36

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
SCHEMBL7310578 1.00 CTSL (0.48) CTSLHPGDCTSSCTSKPOLB
SCHEMBL7306331 0.94 CTSL (0.39) CTSLHPGDCTSSCTSKPOLB
SCHEMBL7306348 0.94 CTSL (0.39) CTSLHPGDCTSSCTSKPOLB
SCHEMBL7301740 0.91 CTSL (0.47) CTSLCTSSCTSKPOLBCRHBP
SCHEMBL7301730 0.91 CTSL (0.47) CTSLCTSSCTSKPOLBCRHBP
SCHEMBL7313599 0.91 CTSL (0.44) CTSLHPGDCTSSCTSKPOLB
SCHEMBL7313606 0.91 CTSL (0.44) CTSLHPGDCTSSCTSKPOLB
SCHEMBL7310672 0.90 CTSK (0.44) CTSLCTSKPOLBCRHBPCRHR2
SCHEMBL7310659 0.90 CTSK (0.44) CTSLCTSKPOLBCRHBPCRHR2
SCHEMBL7303804 0.90 POLB (0.48) CTSLCTSSCTSKPOLBCRHBP

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