SCHEMBL4397244

SCHEMBL4397244

O=C1OCc2cc(F)c(F)cc2N1C1CCN(S(=O)(=O)c2ccc3ncccc3c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.54
CHRM5 P08912 5/20 0.45
CHRM4 P08173 1/20 0.42
KDM2B Q8NHM5 1/20 0.42
RXFP1 Q9HBX9 1/20 0.40
CHRM1 P11229 1/20 0.40
EPHX2 P34913 1/20 0.39
FASN P49327 1/20 0.39
GBA1 P04062 1/20 0.38

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
SCHEMBL4402141 0.90 HTR6 (0.56) HTR6CHRM5CHRM4KDM2BRXFP1
SCHEMBL4401105 0.89 HTR6 (0.56) HTR6CHRM5CHRM4KDM2BCHRM1
SCHEMBL4395155 0.88 HTR6 (0.69) HTR6CHRM5CHRM4KDM2B
SCHEMBL3147534 0.87 HTR6 (0.54) HTR6
SCHEMBL4402081 0.87 HTR6 (0.56) HTR6CHRM5CHRM4
SCHEMBL4394478 0.87 HTR6 (0.56) HTR6CHRM5CHRM4EPHX2
SCHEMBL3140246 0.84 HTR6 (0.77) HTR6
SCHEMBL4397820 0.82 HTR6 (0.54) HTR6CHRM5CHRM4KDM2BCHRM1
SCHEMBL4394397 0.82 HTR6 (0.72) HTR6CHRM5CHRM4KDM2BEPHX2
SCHEMBL3148997 0.81 HTR6 (0.50) HTR6RXFP1CHRM1

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-1648886-B1 BENZOXAZINONE-DERIVED SULFONAMIDE COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS ESTEVE LABOR DR (ES) 2009-12-09 EP claimed