SCHEMBL6823022

SCHEMBL6823022

CN1CC[C@@H](Oc2cc(NS(=O)(=O)c3ccc(F)cc3)ccc2Cl)C1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 8/20 0.64
HTR2C P28335 2/20 0.48
HTR2B P41595 1/20 0.48
HSD17B3 P37058 1/20 0.47
HSD17B2 P37059 1/20 0.47
ALDH1A1 P00352 2/20 0.45
HPGD P15428 1/20 0.45
TP53 P04637 1/20 0.45
PKM P14618 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HTR6 P50406 2/20 0.45
POLB P06746 1/20 0.45
DRD2 P14416 1/20 0.45
HTR2A P28223 1/20 0.45
DRD3 P35462 1/20 0.45
GHSR Q92847 1/20 0.44
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL6823026 1.00 UTS2R (0.64) UTS2RHTR2CHTR2BHSD17B3HSD17B2
SCHEMBL8342919 0.92 UTS2R (0.66) UTS2RHTR2CHTR2BALDH1A1HTR6
SCHEMBL8342926 0.91 UTS2R (0.65) UTS2RHTR2CHTR2BALDH1A1POLB
SCHEMBL8342609 0.90 UTS2R (0.64) UTS2RHTR2CALDH1A1HTR6DRD2
SCHEMBL8340488 0.90 UTS2R (0.69) UTS2RHTR2CHTR2BALDH1A1HTR6
SCHEMBL5835420 0.89 UTS2R (0.61) UTS2RHTR2CHTR2BALDH1A1SMN1; SMN2
SCHEMBL8342415 0.89 UTS2R (0.61) UTS2RHTR6MEN1KMT2A
SCHEMBL5835413 0.89 UTS2R (0.61) UTS2RHTR2CHTR2BALDH1A1SMN1; SMN2
SCHEMBL5835458 0.89 UTS2R (0.63) UTS2RALDH1A1PKMSMN1; SMN2HTR6
SCHEMBL5835453 0.89 UTS2R (0.63) UTS2RALDH1A1PKMSMN1; SMN2HTR6

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-2004043366-A2 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO claimed
WO-2004043366-A2 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed