SCHEMBL5374096

SCHEMBL5374096

CNS(=O)(=O)c1cccc(-c2ccc3[nH]c4c(c3c2)CN(c2ncc(C(=O)O)c(C)n2)CC4)c1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BAZ2B Q9UIF8 8/20 0.51
SIRT2 Q8IXJ6 1/20 0.42
HTR6 P50406 7/20 0.38
HTR1A P08908 2/20 0.38
HTR2C P28335 2/20 0.38
HTR7 P34969 2/20 0.38
DGAT2 Q96PD7 1/20 0.38
CYP11B2 P19099 1/20 0.37
HPGDS O60760 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
SCHEMBL2986272 0.86 SIRT2 (0.46) BAZ2BSIRT2
SCHEMBL2978359 0.84 DHODH (0.44) BAZ2BSIRT2
SCHEMBL2970394 0.84 SIRT2 (0.44) BAZ2BSIRT2
SCHEMBL2973482 0.84 SIRT2 (0.44) BAZ2BSIRT2
SCHEMBL5374091 0.83 BAZ2B (0.53) BAZ2BSIRT2HTR6HTR1AHTR2C
SCHEMBL2980535 0.83 SIRT2 (0.44) BAZ2BSIRT2
SCHEMBL4939629 0.83 BAZ2B (0.53) BAZ2BSIRT2HTR6HTR1AHTR2C
SCHEMBL2978681 0.83 SIRT2 (0.44) BAZ2BSIRT2
SCHEMBL2980633 0.83 SIRT2 (0.43) BAZ2BSIRT2HTR6
SCHEMBL2972061 0.82 SIRT2 (0.41) BAZ2BSIRT2

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-1851219-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS INHIBITORS OF HISTONE DEACETYLASE Miikana Therapeutics, Inc. (US) 2007-11-07 EP disclosed
WO-2006088949-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS INHIBITORS OF HISTONE DEACETYLASE MIIKANA THERAPEUTICS, INC. (US) 2006-08-24 WO disclosed