SCHEMBL5010683

SCHEMBL5010683

CC(=O)c1ccc(S(=O)(=O)N(CCN(C)C)Cc2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.70
HTR2C P28335 1/20 0.70
SLC6A4 P31645 1/20 0.70
TAS2R14 Q9NYV8 12/20 0.62
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
ALDH1A1 P00352 1/20 0.56
PKM P14618 1/20 0.56
HTT P42858 1/20 0.56
RECQL P46063 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
HSD17B10 Q99714 1/20 0.56
MAPT P10636 1/20 0.55
TP53 P04637 1/20 0.55
POLB P06746 1/20 0.55
CNR2 P34972 1/20 0.54
CXCR3 P49682 1/20 0.54
PTGES O14684 1/20 0.54
TAS2R8 Q9NYW2 1/20 0.54

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
SCHEMBL6300788 0.89 TAS2R14 (0.77) TAS2R14MEN1KMT2AALDH1A1PKM
SCHEMBL5010583 0.86 HTR2A (0.81) HTR2AHTR2CSLC6A4TAS2R14MEN1
SCHEMBL5011454 0.83 HTR2A (0.77) HTR2AHTR2CSLC6A4TAS2R14MEN1
SCHEMBL5011732 0.82 HTR2A (1.00) HTR2AHTR2CSLC6A4TAS2R14MEN1
SCHEMBL5010582 0.80 CNR2 (0.71) HTR2AHTR2CSLC6A4TAS2R14MEN1
SCHEMBL5011430 0.79 HTR2A (0.70) HTR2AHTR2CSLC6A4TAS2R14MEN1
SCHEMBL5009431 0.78 CNR2 (0.73) HTR2AHTR2CSLC6A4TAS2R14MEN1
SCHEMBL1278616 0.77 TAS2R14 (1.00) TAS2R14MEN1KMT2ACXCR3PTGES
SCHEMBL5011405 0.77 HTR2A (0.70) HTR2AHTR2CSLC6A4TAS2R14MEN1
SCHEMBL1278788 0.76 TAS2R14 (0.97) TAS2R14MEN1KMT2ACXCR3PTGES

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-2008093919-A1 USE OF N-BENZYL-N-(2-DIMETHYLAMINO-ETHYL)BENZENESULFONAMIDE DERIVATIVES FOR TREATING CENTRAL NERVOUS SYSTEM DISORDERS DONGBU HITEK CO., LTD. (KR) 2008-08-07 WO claimed
WO-2008093919-A1 USE OF N-BENZYL-N-(2-DIMETHYLAMINO-ETHYL)BENZENESULFONAMIDE DERIVATIVES FOR TREATING CENTRAL NERVOUS SYSTEM DISORDERS DONGBU HITEK CO., LTD. (KR) 2008-08-07 WO disclosed