SCHEMBL4075529

SCHEMBL4075529

O=[N+]([O-])c1ccccc1S(=O)(=O)NC1CCC(CCN2CCN(c3cccc(Cl)c3Cl)CC2)CC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 13/20 0.57
DRD3 P35462 11/20 0.57
HTR1A P08908 2/20 0.54
ADRA2A P08913 2/20 0.54
DRD4 P21917 2/20 0.54
HTR2A P28223 2/20 0.54
HTR2C P28335 2/20 0.54
HTR7 P34969 2/20 0.54
ADRA1A P35348 2/20 0.54
HRH1 P35367 2/20 0.54
ABCB11 O95342 1/20 0.54
CHRM2 P08172 1/20 0.54
CHRM1 P11229 1/20 0.54
DRD1 P21728 1/20 0.54
DRD5 P21918 1/20 0.54
HTR2B P41595 1/20 0.54
KCNH2 Q12809 1/20 0.54
CHRM4 P08173 1/20 0.54
ADRB1 P08588 1/20 0.54
CHRM5 P08912 1/20 0.54

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
SCHEMBL29282523 0.77 DRD2 (0.62) DRD2DRD3HTR1AADRA2ADRD4
SCHEMBL30890931 0.77 DRD2 (0.62) DRD2DRD3HTR1AADRA2ADRD4
SCHEMBL29282525 0.77 DRD2 (0.62) DRD2DRD3HTR1AADRA2ADRD4
SCHEMBL4084481 0.77 DRD2 (0.58) DRD2DRD3HTR1AADRA2ADRD4
SCHEMBL18073598 0.75 DRD2 (0.75) DRD2DRD3HTR1AADRA2ADRD4
SCHEMBL18950703 0.75 DRD2 (0.72) DRD2DRD3HTR1AADRA2ADRD4
SCHEMBL18950687 0.75 DRD2 (0.75) DRD2DRD3HTR1AADRA2ADRD4
SCHEMBL21795356 0.74 DRD2 (0.88) DRD2DRD3HTR1AADRA2ADRD4
SCHEMBL4075434 0.74 DRD2 (0.56) DRD2DRD3HTR1AHTR2AHTR7
SCHEMBL31708210 0.74 DRD2 (0.82) DRD2DRD3HTR1AADRA2ADRD4

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