SCHEMBL4813612

SCHEMBL4813612

CCCC[C@H](NC(=O)O)C(=O)C(=O)NC(C)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSK P43235 20/20 0.72
CTSL P07711 5/20 0.65
CTSS P25774 5/20 0.65
CTSB P07858 1/20 0.65
CTSH P09668 1/20 0.65
CTSV O60911 3/20 0.64

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
SCHEMBL4813617 1.00 CTSK (0.72) CTSKCTSLCTSSCTSBCTSH
SCHEMBL5637804 1.00 CTSK (0.72) CTSKCTSLCTSSCTSBCTSH
SCHEMBL4813599 1.00 CTSK (0.72) CTSKCTSLCTSSCTSBCTSH
SCHEMBL4819313 0.82 CTSK (0.59) CTSKCTSLCTSSCTSBCTSH
SCHEMBL4819332 0.82 CTSK (0.59) CTSKCTSLCTSSCTSBCTSH
SCHEMBL15237928 0.81 CTSK (0.66) CTSKCTSLCTSSCTSB
SCHEMBL14943214 0.81 CTSK (0.61) CTSKCTSLCTSSCTSBCTSH
SCHEMBL12487120 0.80 CTSK (0.60) CTSKCTSLCTSSCTSBCTSH
SCHEMBL10255250 0.77 CTSK (0.58) CTSKCTSLCTSSCTSBCTSH
SCHEMBL13350503 0.77 CTSK (0.58) CTSKCTSLCTSSCTSBCTSH

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
US-7402606-B2 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin K inhibitors for the treatment of bone loss SMITHKLINE BEECHAM CORPORATION (US) 2008-07-22 US claimed