SCHEMBL6828716

SCHEMBL6828716

CN1CCC(Oc2cc(NS(=O)(=O)c3cc(-c4cccc(N)c4)c(Cl)s3)ccc2C(F)(F)F)C1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 16/20 0.54
PFKFB3 Q16875 1/20 0.38
CHRM3 P20309 2/20 0.35
BCAT2 O15382 1/20 0.34

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
SCHEMBL6828714 1.00 UTS2R (0.54) UTS2RPFKFB3CHRM3BCAT2
SCHEMBL6826108 0.92 UTS2R (0.55) UTS2RPFKFB3BCAT2
SCHEMBL6826105 0.92 UTS2R (0.55) UTS2RPFKFB3BCAT2
SCHEMBL6828350 0.92 UTS2R (0.56) UTS2RPFKFB3
SCHEMBL6829911 0.90 UTS2R (0.57) UTS2RPFKFB3
SCHEMBL6829906 0.90 UTS2R (0.57) UTS2RPFKFB3
SCHEMBL6828957 0.90 UTS2R (0.53) UTS2RPFKFB3CHRM3
SCHEMBL6828954 0.90 UTS2R (0.53) UTS2RPFKFB3CHRM3
SCHEMBL6829210 0.89 UTS2R (0.54) UTS2R
SCHEMBL6829204 0.89 UTS2R (0.54) 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-2004043368-A2 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed