SCHEMBL6587635

SCHEMBL6587635

Cc1occc1OC(=O)N[C@@H](CC(C)(C)C(C)C)C(=O)NC1C(=O)COC1CCN(C)C

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSL P07711 15/20 0.40
CTSK P43235 15/20 0.40
CTSS P25774 14/20 0.40
UTS2R Q9UKP6 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
SCHEMBL6590428 0.93 CTSL (0.47) CTSLCTSKCTSS
SCHEMBL6592370 0.91 CTSL (0.41) CTSLCTSKCTSS
SCHEMBL6590577 0.90 CTSL (0.49) CTSLCTSKCTSS
SCHEMBL6594012 0.89 CTSK (0.38) CTSLCTSKCTSSUTS2R
SCHEMBL6586690 0.88 CTSL (0.34) CTSLCTSKCTSSUTS2R
SCHEMBL6594578 0.87 CTSL (0.34) CTSLCTSKCTSSUTS2R
SCHEMBL6592491 0.87 CTSK (0.38) CTSLCTSKCTSSUTS2R
SCHEMBL6587998 0.87 CTSL (0.34) CTSLCTSKCTSSUTS2R
SCHEMBL6476157 0.86 CTSL (0.45) CTSLCTSKCTSS
SCHEMBL6588604 0.86 CTSK (0.38) CTSLCTSKCTSS

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