SCHEMBL7524903

SCHEMBL7524903

CC(C)(CC(NC(=O)c1ccccc1)C(=O)NC1C(=O)CO[C@H]1CN1CCCC1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSK P43235 20/20 0.51
CTSL P07711 19/20 0.51
CTSS P25774 19/20 0.51

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
SCHEMBL6483013 1.00 CTSK (0.51) CTSKCTSLCTSS
SCHEMBL6486286 0.92 CTSK (0.60) CTSKCTSLCTSS
SCHEMBL7526731 0.92 CTSK (0.60) CTSKCTSLCTSS
SCHEMBL6486718 0.92 CTSL (0.47) CTSKCTSLCTSS
SCHEMBL6488412 0.91 CTSL (0.46) CTSKCTSLCTSS
SCHEMBL6475643 0.91 CTSL (0.65) CTSKCTSLCTSS
SCHEMBL6486821 0.90 CTSL (0.53) CTSKCTSLCTSS
SCHEMBL6476225 0.90 CTSK (0.51) CTSKCTSLCTSS
SCHEMBL7531079 0.90 CTSK (0.51) CTSKCTSLCTSS
SCHEMBL6475727 0.88 CTSL (0.64) CTSKCTSLCTSS

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