SCHEMBL6589218

SCHEMBL6589218

CC(C)(Cc1ccccc1)C[C@H](NC(=O)Oc1ccoc1)C(=O)NC1C(=O)COC1CN1CCCC1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSK P43235 19/20 0.38
CTSS P25774 15/20 0.38
CTSL P07711 13/20 0.38
CTSB P07858 3/20 0.34

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
SCHEMBL6592446 0.93 CTSK (0.37) CTSKCTSSCTSLCTSB
SCHEMBL6589788 0.90 CTSL (0.41) CTSKCTSSCTSL
SCHEMBL6592608 0.90 CTSL (0.46) CTSKCTSSCTSL
SCHEMBL6590095 0.90 CTSK (0.38) CTSKCTSSCTSLCTSB
SCHEMBL6592875 0.88 CTSK (0.37) CTSKCTSSCTSLCTSB
SCHEMBL6593114 0.88 CTSK (0.47) CTSKCTSSCTSLCTSB
SCHEMBL6476274 0.87 CTSL (0.46) CTSKCTSSCTSL
SCHEMBL6592614 0.87 CTSK (0.38) CTSKCTSSCTSLCTSB
SCHEMBL6588307 0.86 CTSK (0.37) CTSKCTSSCTSLCTSB
SCHEMBL6589053 0.86 CTSK (0.37) CTSKCTSSCTSLCTSB

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