SCHEMBL6187752

SCHEMBL6187752

O=S(=O)(NCCc1cccc(CCc2ccccc2OCCCN2CCN(c3ccc(F)cc3)CC2)c1)c1ccc(Cl)cc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 9/20 0.61
HTR7 P34969 6/20 0.52
HTR1A P08908 4/20 0.51
HTR2A P28223 2/20 0.51
HTR2C P28335 1/20 0.51
DRD2 P14416 3/20 0.48
DRD3 P35462 3/20 0.48
DRD1 P21728 1/20 0.48
DRD5 P21918 1/20 0.48
HTR6 P50406 4/20 0.48
DRD4 P21917 2/20 0.47
ADRA1D P25100 2/20 0.47
ADRA1A P35348 2/20 0.47
ADRA1B P35368 2/20 0.47

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
SCHEMBL6184857 0.96 ABCB1 (0.61) ABCB1HTR7HTR1AHTR2AHTR2C
SCHEMBL6184263 0.91 ABCB1 (0.51) ABCB1HTR7HTR1AHTR2AHTR2C
SCHEMBL6182420 0.87 ABCB1 (0.50) ABCB1HTR7
SCHEMBL6184568 0.77 TBXA2R (0.54)
SCHEMBL4176822 0.76 ABCB1 (1.00) ABCB1DRD2
SCHEMBL7225705 0.76 HTR2A (0.56) HTR7HTR1AHTR2ADRD2HTR6
SCHEMBL6183970 0.75 TBXA2R (0.56)
Hydrochloric Acid SCHEMBL7226979 0.75 HTR2A (0.55) HTR7HTR1AHTR2ADRD2HTR6
SCHEMBL6183084 0.75 TBXA2R (0.54)
SCHEMBL4182261 0.74 ABCB1 (1.00) ABCB1DRD2

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
EP-1275641-B1 Benzenesulfonamide derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2005-01-12 EP disclosed
EP-1275641-A2 Benzenesulfonamide derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2003-01-15 EP disclosed