SCHEMBL6590885

SCHEMBL6590885

CN(C)CCC1OCC(=O)C1NC(=O)[CH]CC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34

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
SCHEMBL6589594 0.90 CTSL (0.33) CTSLCTSSCTSK
SCHEMBL6591132 0.89 CTSL (0.32) CTSLCTSSCTSK
SCHEMBL6589057 0.89 CTSL (0.31) CTSLCTSSCTSK
SCHEMBL6589556 0.88 CTSL (0.30) CTSLCTSSCTSK
SCHEMBL6594858 0.85 CTSL (0.31) CTSLCTSSCTSK
SCHEMBL6589411 0.85 CHRM2 (0.33) CTSLCTSSCTSK
SCHEMBL6592697 0.83 CTSL (0.33) CTSLCTSSCTSK
SCHEMBL6588417 0.82 CHRM2 (0.32) CTSLCTSSCTSK
SCHEMBL6591206 0.82 SSTR4 (0.32) CTSLCTSSCTSK
SCHEMBL7111617 0.82 CHRM2 (0.32) CTSLCTSSCTSK

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-1413580-A1 Furanone derivatives as inhibitors of Cathepsin S Medivir UK Ltd (GB) 2004-04-28 EP claimed
EP-1178986-B1 FURANONE DERIVATIVES AS INHIBITORS OF CATHEPSIN S MEDIVIR UK LTD (GB) 2004-02-25 EP claimed
EP-1413580-A1 Furanone derivatives as inhibitors of Cathepsin S Medivir UK Ltd (GB) 2004-04-28 EP disclosed