SCHEMBL4394397

SCHEMBL4394397

Cc1cccc2c1N(C1CCN(S(=O)(=O)c3ccc4ncccc4c3)CC1)C(=O)OC2

nearest known ligand 0.72

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.72
CHRM5 P08912 3/20 0.49
EPHX2 P34913 1/20 0.44
CHRM4 P08173 1/20 0.44
KDM2B Q8NHM5 1/20 0.42

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
SCHEMBL4393846 0.89 HTR6 (0.57) HTR6CHRM5CHRM4KDM2B
SCHEMBL4399483 0.89 HTR6 (0.61) HTR6CHRM5
SCHEMBL3152438 0.87 HTR6 (0.73) HTR6
SCHEMBL4395155 0.86 HTR6 (0.69) HTR6CHRM5CHRM4KDM2B
SCHEMBL4394478 0.84 HTR6 (0.56) HTR6CHRM5EPHX2CHRM4
SCHEMBL3142878 0.84 HTR6 (0.68) HTR6
SCHEMBL3152764 0.84 HTR6 (0.68) HTR6
SCHEMBL4394394 0.84 HTR6 (1.00) HTR6
SCHEMBL3147482 0.83 HTR6 (0.66) HTR6
SCHEMBL3152345 0.82 HTR6 (0.68) HTR6EPHX2

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