SCHEMBL6815846

SCHEMBL6815846

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

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 18/20 0.57
HTR6 P50406 1/20 0.36
FFAR4 Q5NUL3 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
SCHEMBL6815857 1.00 UTS2R (0.57) UTS2RHTR6FFAR4
SCHEMBL8342189 0.92 UTS2R (0.59) UTS2RFFAR4
SCHEMBL8342604 0.90 UTS2R (0.57) UTS2RFFAR4
SCHEMBL6819207 0.89 UTS2R (0.56) UTS2RHTR6
SCHEMBL6819203 0.89 UTS2R (0.56) UTS2RHTR6
SCHEMBL6828351 0.88 UTS2R (0.63) UTS2RHTR6
SCHEMBL6828353 0.88 UTS2R (0.63) UTS2RHTR6
SCHEMBL8340971 0.88 UTS2R (0.55) UTS2RHTR6
SCHEMBL6822884 0.87 UTS2R (0.55) UTS2R
SCHEMBL6821322 0.87 UTS2R (0.55) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004043917-A1 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed
WO-2004043917-A1 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed
WO-2004043366-A2 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed