SCHEMBL6591010

SCHEMBL6591010

CC(C)C(C)C[C@H](NC(=O)ON1CCOCC1)C(=O)NC1C(=O)COC1CCN(C)C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSL P07711 8/20 0.32
CTSS P25774 8/20 0.32
CTSK P43235 8/20 0.32
UTS2R Q9UKP6 1/20 0.32

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
SCHEMBL6594620 0.92 CTSL (0.32) CTSLCTSSCTSKUTS2R
SCHEMBL6586623 0.89 CTSL (0.40) CTSLCTSSCTSK
SCHEMBL6592458 0.89 CTSS (0.33) CTSLCTSSCTSKUTS2R
SCHEMBL6594368 0.87 CTSS (0.45) CTSLCTSSCTSK
SCHEMBL6475996 0.87 CTSS (0.41) CTSS
SCHEMBL6587320 0.87 CTSL (0.38) CTSLCTSSCTSK
SCHEMBL6589284 0.85 CTSL (0.33) CTSLCTSSCTSK
SCHEMBL6591783 0.85 CTSL (0.40) CTSLCTSSCTSK
SCHEMBL6591046 0.85 CTSK (0.35) CTSLCTSSCTSK
SCHEMBL6590003 0.82 CTSK (0.39) CTSLCTSSCTSKUTS2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1178986-B1 FURANONE DERIVATIVES AS INHIBITORS OF CATHEPSIN S MEDIVIR UK LTD (GB) 2004-02-25 EP claimed