SCHEMBL4046656

SCHEMBL4046656

CCCC(NC(=O)Oc1ccoc1)C(=O)N1CCC2C1C(=O)CN2S(=O)(=O)c1ccccn1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 20/20 0.40
CTSL P07711 19/20 0.40
CTSS P25774 18/20 0.40
CTSV O60911 1/20 0.37
CTSB P07858 1/20 0.37

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
SCHEMBL4047540 0.93 CTSK (0.47) CTSKCTSLCTSSCTSVCTSB
SCHEMBL4043679 0.92 CTSK (0.46) CTSKCTSLCTSSCTSVCTSB
SCHEMBL4041785 0.90 PREP (0.35) CTSKCTSLCTSS
SCHEMBL4047765 0.90 PREP (0.35) CTSKCTSLCTSS
SCHEMBL4042234 0.89 ELOVL6 (0.39) CTSKCTSLCTSSCTSVCTSB
SCHEMBL4047616 0.89 CTSL (0.46) CTSKCTSLCTSSCTSVCTSB
SCHEMBL4044230 0.88 CTSL (0.40) CTSKCTSLCTSSCTSVCTSB
SCHEMBL4044283 0.88 CTSK (0.45) CTSKCTSLCTSSCTSVCTSB
SCHEMBL4046503 0.87 CTSL (0.37) CTSKCTSLCTSSCTSVCTSB
SCHEMBL4044048 0.86 HSD17B10 (0.37) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1546150-B1 PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES AMURA THERAPEUTICS LTD (GB) 2009-03-04 EP claimed