SCHEMBL7526609

SCHEMBL7526609

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

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSK P43235 20/20 0.46
CTSL P07711 19/20 0.46
CTSS P25774 19/20 0.46

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
SCHEMBL6477311 1.00 CTSK (0.46) CTSKCTSLCTSS
SCHEMBL7522332 0.93 CTSK (0.47) CTSKCTSLCTSS
SCHEMBL6475731 0.93 CTSK (0.47) CTSKCTSLCTSS
SCHEMBL7524191 0.92 CTSK (0.48) CTSKCTSLCTSS
SCHEMBL6476733 0.92 CTSK (0.48) CTSKCTSLCTSS
SCHEMBL6481722 0.89 CTSL (0.42) CTSKCTSLCTSS
SCHEMBL6475926 0.88 CTSL (0.59) CTSKCTSLCTSS
SCHEMBL6474608 0.88 CTSL (0.41) CTSKCTSLCTSS
SCHEMBL6477154 0.88 CTSK (0.55) CTSKCTSLCTSS
SCHEMBL7478004 0.88 CTSK (0.55) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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