SCHEMBL6826102

SCHEMBL6826102

CN1CC[C@@H](Oc2cc(NS(=O)(=O)c3cc(-c4ccccc4C(F)(F)F)c(Cl)s3)ccc2C(F)(F)F)C1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 16/20 0.57
SCD O00767 2/20 0.38
BCAT2 O15382 1/20 0.36
HTR6 P50406 1/20 0.36

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
SCHEMBL6826104 1.00 UTS2R (0.57) UTS2RSCDBCAT2HTR6
SCHEMBL8338931 0.94 UTS2R (0.57) UTS2R
SCHEMBL6828863 0.94 UTS2R (0.52) UTS2R
SCHEMBL6828865 0.94 UTS2R (0.52) UTS2R
SCHEMBL6828746 0.93 UTS2R (0.55) UTS2RSCD
SCHEMBL6828751 0.93 UTS2R (0.55) UTS2RSCD
SCHEMBL8338633 0.93 UTS2R (0.62) UTS2R
SCHEMBL8338054 0.89 UTS2R (0.57) UTS2RSCD
SCHEMBL6828724 0.89 UTS2R (0.52) UTS2RBCAT2
SCHEMBL6828731 0.89 UTS2R (0.52) UTS2RBCAT2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004043368-A2 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed
WO-2004043368-A2 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed