SCHEMBL7149544

SCHEMBL7149544

CC(C)(C[CH]C(=O)N1CC[C@@H]2OCC(=O)C21)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.42
CTSS P25774 6/20 0.37
CTSV O60911 4/20 0.36
CTSL P07711 3/20 0.36

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
SCHEMBL4449801 1.00 CTSK (0.42) CTSKCTSSCTSVCTSL
SCHEMBL4452931 0.93 CTSK (0.37) CTSKCTSSCTSVCTSL
SCHEMBL4448241 0.79 CTSK (0.42) CTSKCTSSCTSVCTSL
SCHEMBL7153291 0.79 CTSK (0.42) CTSKCTSSCTSVCTSL
SCHEMBL7016866 0.77 CTSS (0.42) CTSKCTSSCTSVCTSL
SCHEMBL4449804 0.73 CTSK (0.44) CTSKCTSSCTSVCTSL
SCHEMBL7017633 0.73 CTSS (0.40) CTSKCTSSCTSVCTSL
SCHEMBL4452652 0.72 CTSK (0.37) CTSKCTSSCTSVCTSL
SCHEMBL7149408 0.72 CTSK (0.37) CTSKCTSSCTSVCTSL
SCHEMBL13677159 0.72 CTSS (0.49) CTSKCTSSCTSVCTSL

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1362052-A1 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES Amura Therapeutics Limited (GB) 2003-11-19 EP disclosed
WO-2002057270-A1 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES AMURA THERAPEUTICS LIMITED (GB) 2002-07-25 WO disclosed