SCHEMBL6590955

SCHEMBL6590955

CC(C)C(C)C[C@H](NC(=O)Oc1ccsc1)C(=O)NC1C(=O)COC1CCN(C)C

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSK P43235 19/20 0.44
CTSL P07711 18/20 0.44
CTSS P25774 18/20 0.44
UTS2R Q9UKP6 1/20 0.35

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
SCHEMBL6590918 0.93 CTSL (0.44) CTSKCTSLCTSSUTS2R
SCHEMBL6592991 0.90 CTSL (0.54) CTSKCTSLCTSS
SCHEMBL6588736 0.89 CTSL (0.45) CTSKCTSLCTSSUTS2R
SCHEMBL6590299 0.87 CTSL (0.51) CTSKCTSLCTSSUTS2R
SCHEMBL6474596 0.86 CTSK (0.61) CTSKCTSLCTSS
SCHEMBL6588976 0.86 CTSL (0.53) CTSKCTSLCTSS
SCHEMBL6592330 0.86 CTSK (0.43) CTSKCTSLCTSS
SCHEMBL6591250 0.85 CTSL (0.44) CTSKCTSLCTSSUTS2R
SCHEMBL6592443 0.84 CTSL (0.49) CTSKCTSLCTSSUTS2R
SCHEMBL6598790 0.83 CTSK (0.48) CTSKCTSLCTSSUTS2R

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