SCHEMBL6593240

SCHEMBL6593240

Cc1occc1OC(=O)N[C@@H](CC(C)(C)C)C(=O)N[C@@H]1C(=O)CO[C@H]1C

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSK P43235 14/20 0.45
CTSS P25774 13/20 0.45
CTSL P07711 12/20 0.45
CTSB P07858 3/20 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
SCHEMBL6588604 0.92 CTSK (0.38) CTSKCTSSCTSLCTSB
SCHEMBL6586665 0.92 CTSL (0.40) CTSKCTSSCTSL
SCHEMBL6593180 0.90 CTSL (0.57) CTSKCTSSCTSL
SCHEMBL6590972 0.90 CTSK (0.37) CTSKCTSSCTSLCTSB
SCHEMBL6588469 0.88 CTSK (0.36) CTSKCTSSCTSLCTSB
SCHEMBL6586706 0.87 CTSK (0.33) CTSKCTSSCTSLCTSB
SCHEMBL6590230 0.87 CTSK (0.35) CTSKCTSSCTSLCTSB
SCHEMBL6589035 0.86 CTSK (0.35) CTSKCTSSCTSLCTSB
SCHEMBL6590445 0.85 CTSK (0.32) CTSKCTSSCTSLCTSB
SCHEMBL6590428 0.85 CTSL (0.47) CTSKCTSSCTSL

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