SCHEMBL6210484

SCHEMBL6210484

CC(CC(N)=O)CC(=O)N1CCC2C1C(=O)CN2S(=O)(=O)c1ccccn1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSL P07711 19/20 0.39
CTSK P43235 19/20 0.39
CTSS P25774 18/20 0.39
CTSB P07858 2/20 0.39
CTSV O60911 1/20 0.39
ELOVL6 Q9H5J4 1/20 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
SCHEMBL6209846 0.87 DPP4 (0.35)
SCHEMBL6210237 0.87 DPP4 (0.34) CTSK
SCHEMBL6209393 0.85 CTSL (0.36) CTSLCTSKCTSSCTSBCTSV
SCHEMBL6210371 0.84 CTSK (0.38) CTSLCTSKCTSSCTSBCTSV
SCHEMBL6208517 0.83 HSD17B10 (0.41) ELOVL6
SCHEMBL6211016 0.82 CTSK (0.37) CTSLCTSKCTSSCTSBCTSV
SCHEMBL4041763 0.82 CTSK (0.45) CTSLCTSKCTSSCTSBCTSV
SCHEMBL6209960 0.81 CTSK (0.39) CTSLCTSKCTSS
SCHEMBL6210259 0.81 MEN1 (0.38) CTSLCTSKCTSSCTSBCTSV
SCHEMBL6214307 0.81 CTSK (0.31) CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1546150-A1 BIOLOGICALLY ACTIVE COMPOUNDS Amura Therapeutics Limited (GB) 2005-06-29 EP claimed
WO-2004007501-A1 BIOLOGICALLY ACTIVE COMPOUNDS AMURA THERAPEUTICS LIMITED (GB) 2004-01-22 WO claimed
EP-1546150-A1 BIOLOGICALLY ACTIVE COMPOUNDS Amura Therapeutics Limited (GB) 2005-06-29 EP disclosed
WO-2004007501-A1 BIOLOGICALLY ACTIVE COMPOUNDS AMURA THERAPEUTICS LIMITED (GB) 2004-01-22 WO disclosed