SCHEMBL4967323

SCHEMBL4967323

CCN(CC)CCc1c[nH]c2ccc(NS(=O)(=O)N/C=C/c3ccccc3)cc12

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 13/20 0.64
HTR1D P28221 3/20 0.49
HTR1A P08908 3/20 0.49
HTR1B P28222 1/20 0.49
MPO P05164 1/20 0.47
KCNH2 Q12809 1/20 0.44
HDAC1 Q13547 1/20 0.44
HTR2A P28223 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
SCHEMBL3139127 0.87 HTR6 (0.66) HTR6HTR1DHTR1AHTR1BMPO
SCHEMBL3139135 0.87 HTR6 (0.66) HTR6HTR1DHTR1AHTR1BMPO
SCHEMBL30464849 0.87 HTR6 (0.66) HTR6HTR1DHTR1AHTR1BMPO
SCHEMBL4970689 0.81 HTR6 (0.83) HTR6HTR1DHTR1AHTR1BMPO
Biphenyl SCHEMBL4969876 0.79 HTR6 (0.78) HTR6HTR1DHTR1AHTR1BMPO
SCHEMBL4966738 0.78 HTR6 (0.75) HTR6HTR1DHTR1AHTR1BMPO
SCHEMBL4970421 0.78 HTR6 (0.50) HTR6HTR1DHTR1AHTR1BMPO
SCHEMBL3144603 0.78 HTR6 (1.00) HTR6HTR1DHTR1AHTR1BMPO
SCHEMBL3323841 0.77 HTR6 (0.74) HTR6HTR1DHTR1AHTR1BMPO
SCHEMBL4970351 0.76 HTR6 (0.84) HTR6HTR1DHTR1AHTR1BMPO

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-1626715-B1 USE OF SULPHONAMIDE DERIVATIVES FOR THE MANUFACTURE OF A MEDICAMENT FOR THE PROPHYLAXIS AND/OR TREATMENT OF DISORDERS OF FOOD INGESTION ESTEVE LABOR DR (ES) 2008-09-10 EP claimed