SCHEMBL7523800

SCHEMBL7523800

CC(C)(C[CH]C(=O)NC1C(=O)CO[C@H]1CN1CCCC1)C(N)=O

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.30
CTSS P25774 1/20 0.30
CTSK P43235 1/20 0.30

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
SCHEMBL6587760 1.00 CTSL (0.30) CTSLCTSSCTSK
SCHEMBL7527408 0.88
SCHEMBL6590381 0.88
SCHEMBL6589304 0.86 CTSL (0.30) CTSLCTSSCTSK
SCHEMBL7533630 0.86 CTSL (0.30) CTSLCTSSCTSK
SCHEMBL7412268 0.85 CTSL (0.39) CTSLCTSSCTSK
SCHEMBL6093202 0.85 CTSL (0.39) CTSLCTSSCTSK
SCHEMBL6590150 0.85 CCR1 (0.32) CTSLCTSSCTSK
SCHEMBL6590478 0.84 HRH3 (0.34) CTSLCTSSCTSK
SCHEMBL7523232 0.82 ABCB1 (0.37)

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002544274-A 2002-12-24 JP claimed
EP-1178986-A2 FURANONE DERIVATIVES AS INHIBITORS OF CATHEPSIN S Medivir UK Ltd (GB) 2002-02-13 EP claimed
WO-2000069855-A2 FURANONE DERIVATIVES AS INHIBITORS OF CATHEPSIN S MEDIVIR UK LIMITED (GB) 2000-11-23 WO claimed
EP-1178986-A2 FURANONE DERIVATIVES AS INHIBITORS OF CATHEPSIN S Medivir UK Ltd (GB) 2002-02-13 EP disclosed
WO-2000069855-A2 FURANONE DERIVATIVES AS INHIBITORS OF CATHEPSIN S MEDIVIR UK LIMITED (GB) 2000-11-23 WO disclosed