SCHEMBL4393846

SCHEMBL4393846

COc1cccc2c1N(C1CCN(S(=O)(=O)c3ccc4ncccc4c3)CC1)C(=O)OC2

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.57
CHRM5 P08912 2/20 0.45
TP53 P04637 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
CHRM4 P08173 1/20 0.42
MAPT P10636 1/20 0.41
KDM2B Q8NHM5 1/20 0.40

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
SCHEMBL4394397 0.89 HTR6 (0.72) HTR6CHRM5CHRM4KDM2B
SCHEMBL4390344 0.89 HTR6 (0.55) HTR6TP53SMN1; SMN2MAPT
SCHEMBL3147607 0.88 HTR6 (0.62) HTR6SMN1; SMN2
SCHEMBL3152766 0.85 HTR6 (0.56) HTR6SMN1; SMN2
SCHEMBL3148711 0.85 HTR6 (0.79) HTR6SMN1; SMN2MAPT
SCHEMBL4395155 0.84 HTR6 (0.69) HTR6CHRM5CHRM4KDM2B
SCHEMBL3153572 0.81 HTR6 (0.62) HTR6SMN1; SMN2MAPT
SCHEMBL3137601 0.81 HTR6 (0.57) HTR6CHRM5
SCHEMBL4402141 0.81 HTR6 (0.56) HTR6CHRM5TP53SMN1; SMN2CHRM4
SCHEMBL4394478 0.81 HTR6 (0.56) HTR6CHRM5CHRM4MAPT

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