SCHEMBL6817529

SCHEMBL6817529

CN1CC[C@@H](Oc2cc(NS(=O)(=O)c3ccc(Sc4cc(Cl)cc(Cl)c4)s3)ccc2C(F)(F)F)C1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 18/20 0.58
HTR6 P50406 2/20 0.39
DRD2 P14416 1/20 0.36
HTR2C P28335 1/20 0.36
DRD3 P35462 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
SCHEMBL6817536 1.00 UTS2R (0.58) UTS2RHTR6DRD2HTR2CDRD3
SCHEMBL6821457 0.91 UTS2R (0.55) UTS2RHTR6
SCHEMBL6821465 0.91 UTS2R (0.55) UTS2RHTR6
SCHEMBL6817508 0.91 UTS2R (0.57) UTS2RHTR6
SCHEMBL6817515 0.91 UTS2R (0.57) UTS2RHTR6
SCHEMBL6820424 0.90 UTS2R (0.59) UTS2RHTR6
SCHEMBL6820413 0.90 UTS2R (0.59) UTS2RHTR6
SCHEMBL8339024 0.90 UTS2R (0.59) UTS2RHTR6
SCHEMBL8338925 0.89 UTS2R (0.57) UTS2RHTR6DRD2HTR2CDRD3
SCHEMBL6823733 0.89 UTS2R (0.58) UTS2RHTR6

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-2004043917-A1 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO claimed
WO-2004043917-A1 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed