SCHEMBL6825087

SCHEMBL6825087

CN1CCC(Oc2cc(NS(=O)(=O)c3cnc(Oc4cc(Cl)cc(Cl)c4)c(Br)c3)ccc2C(F)(F)F)C1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 17/20 0.58
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38
GPR119 Q8TDV5 1/20 0.37
FGFR1 P11362 1/20 0.37
KDR P35968 1/20 0.37

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
SCHEMBL6818562 1.00 UTS2R (0.58) UTS2RSCN5ASCN9AGPR119FGFR1
SCHEMBL6818819 0.92 UTS2R (0.59) UTS2RKDR
SCHEMBL6822584 0.91 UTS2R (0.56) UTS2RFGFR1KDR
SCHEMBL6822582 0.91 UTS2R (0.56) UTS2RFGFR1KDR
SCHEMBL6674000 0.91 UTS2R (0.58) UTS2RSCN9AKDR
SCHEMBL6674005 0.91 UTS2R (0.58) UTS2RSCN9AKDR
SCHEMBL6825135 0.90 UTS2R (0.63) UTS2R
SCHEMBL6824855 0.90 UTS2R (0.59) UTS2R
SCHEMBL6825126 0.90 UTS2R (0.63) UTS2R
SCHEMBL6824846 0.90 UTS2R (0.59) UTS2R

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
WO-2004043948-A1 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO claimed