SCHEMBL5230698

SCHEMBL5230698

COc1ccc2c(c1)c(CCN(C)C)cn2S(=O)(=O)c1ccccc1Br

nearest known ligand 0.78

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.78
HTR1A P08908 1/20 0.74
DRD2 P14416 1/20 0.74
HTR1D P28221 1/20 0.74
HTR1B P28222 1/20 0.74
HTR1E P28566 1/20 0.74
HTR1F P30939 1/20 0.74
HTR7 P34969 1/20 0.74
DRD3 P35462 1/20 0.74
CYP3A4 P08684 1/20 0.66
ADRA2A P08913 1/20 0.66
CYP2D6 P10635 1/20 0.66
ADRA2C P18825 1/20 0.66
HTR2A P28223 1/20 0.66
CYP2C19 P33261 1/20 0.66

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
SCHEMBL5225858 0.93 HTR6 (0.77) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5226801 0.89 HTR6 (0.72) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5502509 0.88 HTR6 (1.00) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5230855 0.88 HTR6 (0.70) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL3601701 0.87 HTR6 (0.68) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5230637 0.87 HTR6 (0.71) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL3589401 0.86 HTR6 (0.59) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5227127 0.86 HTR6 (0.72) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5231472 0.86 HTR6 (0.67) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL3592630 0.85 HTR6 (0.64) HTR6HTR1ADRD2HTR1DHTR1B

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1523486-B1 TETRACYCLIC ARYLSULFONYL INDOLES HAVING SEROTONIN RECEPTOR AFFINITY SUVEN LIFE SCIENCES LTD (IN) 2007-11-07 EP disclosed