SCHEMBL6590208

SCHEMBL6590208

C[C@@H]1OCC(=O)[C@H]1NC(=O)[C@H](CC(C)(C)C)NC(=O)Oc1ccoc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSL P07711 20/20 0.46
CTSS P25774 19/20 0.46
CTSK P43235 19/20 0.46
CTSB P07858 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
SCHEMBL6593379 0.92 CTSL (0.40) CTSLCTSSCTSK
SCHEMBL6591197 0.92 CTSL (0.39) CTSLCTSSCTSKCTSB
SCHEMBL6591117 0.90 CTSL (0.58) CTSLCTSSCTSK
SCHEMBL6592634 0.89 CTSK (0.37) CTSLCTSSCTSKCTSB
SCHEMBL6589053 0.88 CTSK (0.37) CTSLCTSSCTSKCTSB
SCHEMBL6590307 0.87 CTSL (0.34) CTSLCTSSCTSKCTSB
SCHEMBL6591090 0.86 CTSK (0.36) CTSLCTSSCTSKCTSB
SCHEMBL6594928 0.86 CTSK (0.35) CTSLCTSSCTSKCTSB
SCHEMBL6597144 0.86 CTSL (0.48) CTSLCTSSCTSK
SCHEMBL6589313 0.85 CTSL (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 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