SCHEMBL6590299

SCHEMBL6590299

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

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSL P07711 17/20 0.51
CTSK P43235 17/20 0.51
CTSS P25774 16/20 0.51
UTS2R Q9UKP6 1/20 0.33

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
SCHEMBL6588976 0.91 CTSL (0.53) CTSLCTSKCTSS
SCHEMBL6591732 0.90 CTSL (0.62) CTSLCTSKCTSS
SCHEMBL6592443 0.89 CTSL (0.49) CTSLCTSKCTSSUTS2R
SCHEMBL6588736 0.88 CTSL (0.45) CTSLCTSKCTSSUTS2R
SCHEMBL6590955 0.87 CTSK (0.44) CTSLCTSKCTSSUTS2R
SCHEMBL6591726 0.87 CTSL (0.41) CTSLCTSKCTSSUTS2R
SCHEMBL6598790 0.87 CTSK (0.48) CTSLCTSKCTSSUTS2R
SCHEMBL6590918 0.87 CTSL (0.44) CTSLCTSKCTSSUTS2R
SCHEMBL6488834 0.86 CTSL (0.69) CTSLCTSKCTSS
SCHEMBL6590653 0.86 CTSK (0.49) 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