SCHEMBL4600925

SCHEMBL4600925

CN(C)c1nc2c(nc1C#N)C(=O)c1ccccc1-2.COCCOc1nc2c(nc1C#N)C(=O)c1ccccc1-2

nearest known ligand 0.83

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
USP8 P40818 17/20 0.83
USP7 Q93009 9/20 0.51
USP47 Q96K76 4/20 0.51
SQOR Q9Y6N5 1/20 0.36
TP53 P04637 1/20 0.35

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
SCHEMBL1512579 0.91 USP8 (1.00) USP8USP7USP47SQOR
SCHEMBL4053539 0.87 USP8 (0.81) USP8USP7USP47TP53
SCHEMBL4614200 0.86 USP8 (0.61) USP8USP7USP47
SCHEMBL1512437 0.84 USP8 (0.71) USP8USP7USP47
SCHEMBL4053748 0.83 USP8 (0.58) USP8USP7USP47
SCHEMBL4052507 0.79 USP8 (0.52) USP8USP7USP47
SCHEMBL1512549 0.77 USP8 (1.00) USP8USP7USP47TP53
SCHEMBL4599977 0.76 USP8 (0.62) USP8USP7USP47TP53
SCHEMBL30931160 0.71 USP8 (1.00) USP8USP7USP47
SCHEMBL1512485 0.71 USP8 (1.00) USP8USP7USP47

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-1912954-A2 NOVEL CYSTEINE PROTEASE INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS Hybrigenics S.A. (FR) 2008-04-23 EP disclosed
WO-2007017758-A2 NOVEL CYSTEINE PROTEASE INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS HYBRIGENICS SA (FR) 2007-02-15 WO disclosed