SCHEMBL6828977

SCHEMBL6828977

CN1CC[C@@H](Oc2cc(NS(=O)(=O)c3cc(-c4ccc(Cl)cc4Cl)c(Cl)s3)ccc2C(F)(F)F)C1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 16/20 0.56
FPR2 P25090 3/20 0.38
PROKR1 Q8TCW9 3/20 0.38
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37

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
SCHEMBL6828983 1.00 UTS2R (0.56) UTS2RFPR2PROKR1HTR2CHTR2B
SCHEMBL8338940 0.91 UTS2R (0.62) UTS2R
SCHEMBL8338931 0.91 UTS2R (0.57) UTS2R
SCHEMBL6828891 0.90 UTS2R (0.57) UTS2RHTR2C
SCHEMBL6828887 0.90 UTS2R (0.57) UTS2RHTR2C
SCHEMBL6826102 0.89 UTS2R (0.57) UTS2R
SCHEMBL6826104 0.89 UTS2R (0.57) UTS2R
SCHEMBL6828702 0.89 UTS2R (0.57) UTS2RHTR2C
SCHEMBL6828704 0.89 UTS2R (0.57) UTS2RHTR2C
SCHEMBL6828353 0.88 UTS2R (0.63) 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 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