SCHEMBL4968171

SCHEMBL4968171

O=S(=O)(Nc1ccc2ccccc2c1)Nc1ccc2[nH]cc(CCN3CCCC3)c2c1

nearest known ligand 0.84

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 11/20 0.84
MPO P05164 1/20 0.53
HTR1D P28221 4/20 0.53
HTR1B P28222 4/20 0.53
HTR2A P28223 3/20 0.52

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
SCHEMBL4968803 0.91 HTR6 (0.84) HTR6HTR1DHTR1B
SCHEMBL3153292 0.91 HTR6 (1.00) HTR6
SCHEMBL4977226 0.88 HTR6 (0.75) HTR6MPOHTR1DHTR1BHTR2A
SCHEMBL3138888 0.84 HTR6 (0.86) HTR6MPOHTR2A
SCHEMBL3147704 0.83 HTR6 (1.00) HTR6HTR1DHTR1BHTR2A
SCHEMBL3147744 0.83 HTR6 (1.00) HTR6
SCHEMBL3324172 0.81 HTR6 (0.82) HTR6
SCHEMBL4969882 0.80 HTR6 (0.76) HTR6HTR1DHTR1BHTR2A
SCHEMBL4967568 0.80 HTR6 (0.70) HTR6HTR1DHTR1BHTR2A
SCHEMBL4970689 0.78 HTR6 (0.83) HTR6MPOHTR1DHTR1B

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