SCHEMBL5225858

SCHEMBL5225858

COc1ccc(S(=O)(=O)n2cc(CCN(C)C)c3cc(OC)ccc32)c(Br)c1

nearest known ligand 0.77

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.77
HTR1A P08908 1/20 0.72
DRD2 P14416 1/20 0.72
HTR1D P28221 1/20 0.72
HTR1B P28222 1/20 0.72
HTR1E P28566 1/20 0.72
HTR1F P30939 1/20 0.72
HTR7 P34969 1/20 0.72
DRD3 P35462 1/20 0.72

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
SCHEMBL5230855 0.95 HTR6 (0.70) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5230637 0.94 HTR6 (0.71) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5227127 0.93 HTR6 (0.72) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5231472 0.93 HTR6 (0.67) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5230698 0.93 HTR6 (0.78) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5226801 0.92 HTR6 (0.72) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5499078 0.85 HTR6 (1.00) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5502509 0.84 HTR6 (1.00) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL4769961 0.84 HTR6 (0.59) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL4777867 0.84 HTR6 (0.59) 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