SCHEMBL6828735

SCHEMBL6828735

CN1CC[C@@H](Oc2cc(NS(=O)(=O)c3cc(-c4cc(Cl)cc(Cl)c4)c(Cl)s3)ccc2Cl)C1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 13/20 0.56
HTR6 P50406 3/20 0.39
DRD2 P14416 1/20 0.38
HTR2C P28335 1/20 0.38
DRD3 P35462 1/20 0.38
SGK1 O00141 1/20 0.37
PFKFB3 Q16875 2/20 0.36
USP1 O94782 1/20 0.35
USP8 P40818 1/20 0.35
OTUB1 Q96FW1 1/20 0.35
USP36 Q9P275 1/20 0.35

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
SCHEMBL6828739 1.00 UTS2R (0.56) UTS2RHTR6DRD2HTR2CDRD3
SCHEMBL8339640 0.91 UTS2R (0.56) UTS2RHTR6DRD2HTR2CDRD3
SCHEMBL6826100 0.91 UTS2R (0.56) UTS2RHTR6DRD2HTR2CPFKFB3
SCHEMBL6826097 0.91 UTS2R (0.56) UTS2RHTR6DRD2HTR2CPFKFB3
SCHEMBL6830219 0.90 UTS2R (0.53) UTS2RHTR6DRD2HTR2CDRD3
SCHEMBL6830221 0.90 UTS2R (0.53) UTS2RHTR6DRD2HTR2CDRD3
SCHEMBL6828657 0.90 UTS2R (0.55) UTS2RHTR6DRD2HTR2CDRD3
SCHEMBL6828655 0.90 UTS2R (0.55) UTS2RHTR6DRD2HTR2CDRD3
SCHEMBL6828702 0.89 UTS2R (0.57) UTS2RHTR6DRD2HTR2CDRD3
SCHEMBL6828704 0.89 UTS2R (0.57) UTS2RHTR6DRD2HTR2CDRD3

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