SCHEMBL4084481

SCHEMBL4084481

COc1ccc(S(=O)(=O)NC2CCC(CCN3CCN(c4cccc(Cl)c4Cl)CC3)CC2)cc1OC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.58
DRD3 P35462 8/20 0.58
HTR1A P08908 3/20 0.57
DRD4 P21917 3/20 0.57
HTR2A P28223 3/20 0.57
HTR2C P28335 3/20 0.57
DRD1 P21728 2/20 0.57
HTR2B P41595 2/20 0.57
ADRA1A P35348 4/20 0.57
ADRA1B P35368 3/20 0.57
ADRA1D P25100 2/20 0.57
ADRA2A P08913 2/20 0.56
HTR7 P34969 2/20 0.56
HRH1 P35367 2/20 0.56
ABCB11 O95342 1/20 0.56
CHRM2 P08172 1/20 0.56
CHRM1 P11229 1/20 0.56
DRD5 P21918 1/20 0.56
KCNH2 Q12809 1/20 0.56
CHRM4 P08173 1/20 0.55

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
SCHEMBL4254856 0.86 DRD2 (0.56) DRD2DRD3DRD4HTR2AADRA1A
SCHEMBL4084512 0.80 DRD2 (0.48) DRD2DRD3HTR1AHTR2AADRA1A
SCHEMBL30890931 0.80 DRD2 (0.62) DRD2DRD3HTR1ADRD4HTR2A
SCHEMBL29282525 0.80 DRD2 (0.62) DRD2DRD3HTR1ADRD4HTR2A
SCHEMBL29282523 0.80 DRD2 (0.62) DRD2DRD3HTR1ADRD4HTR2A
SCHEMBL4079923 0.79 DRD2 (0.51) DRD2DRD3HTR1AHTR2AADRA1A
SCHEMBL4075285 0.79 DRD3 (0.57) DRD2DRD3HTR1ADRD4HTR2A
SCHEMBL4081134 0.78 DRD2 (0.59) DRD2DRD3HTR1ADRD4HTR2A
SCHEMBL4081131 0.78 DRD2 (0.59) DRD2DRD3HTR1ADRD4HTR2A
SCHEMBL22302939 0.78 DRD2 (0.53) DRD2DRD3HTR1ADRD4HTR2A

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
US-7473692-B2 Sulfonamide derivatives as D3-receptor ligands RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2009-01-06 US claimed
EP-1438302-B1 NEW SULFONAMIDE DERIVATIVES AS D3-RECEPTOR LIGANDS RICHTER GEDEON NYRT (HU) 2012-05-30 EP disclosed