SCHEMBL6820377

SCHEMBL6820377

CN1CC[C@@H](Oc2cc(NS(=O)(=O)c3cc(Br)c(Sc4cc(Cl)cc(Cl)c4)s3)ccc2Cl)C1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 16/20 0.62
HTR6 P50406 3/20 0.37
ERBB2 P04626 1/20 0.36
EPHA2 P29317 1/20 0.36
KDR P35968 1/20 0.36
EPHB4 P54760 1/20 0.36
DRD2 P14416 1/20 0.34
HTR2C P28335 1/20 0.34
DRD3 P35462 1/20 0.34

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
SCHEMBL6821388 0.90 UTS2R (0.62) UTS2R
SCHEMBL6821382 0.90 UTS2R (0.62) UTS2R
SCHEMBL8340275 0.90 UTS2R (0.61) UTS2RHTR6ERBB2EPHA2KDR
SCHEMBL8340583 0.90 UTS2R (0.56) UTS2RHTR6DRD2HTR2CDRD3
SCHEMBL5744180 0.87 UTS2R (0.69) UTS2RHTR6ERBB2EPHA2KDR
SCHEMBL5741755 0.87 UTS2R (0.69) UTS2RHTR6ERBB2EPHA2KDR
SCHEMBL5741757 0.87 UTS2R (0.69) UTS2RHTR6ERBB2EPHA2KDR
SCHEMBL8338925 0.86 UTS2R (0.57) UTS2RHTR6DRD2HTR2CDRD3
SCHEMBL5742998 0.86 UTS2R (0.68) UTS2RHTR6ERBB2EPHA2KDR
SCHEMBL5742992 0.86 UTS2R (0.68) UTS2RHTR6ERBB2EPHA2KDR

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