SCHEMBL4079160

SCHEMBL4079160

O=S(=O)(NC1CCC(CCN2CCN(c3cccc(C(F)(F)F)c3)CC2)CC1)c1ccc(Cl)cc1

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.60
DRD3 P35462 2/20 0.60
HTR1A P08908 1/20 0.52
HTR2A P28223 1/20 0.52
HTR2C P28335 1/20 0.52
HTR7 P34969 1/20 0.52
HTR6 P50406 1/20 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
SCHEMBL4079163 1.00 DRD2 (0.60) DRD2DRD3HTR1AHTR2AHTR2C
Hydrochloric Acid SCHEMBL4079619 0.99 DRD2 (0.59) DRD2DRD3HTR1AHTR2AHTR2C
Hydrochloric Acid SCHEMBL4079616 0.99 DRD2 (0.59) DRD2DRD3HTR1AHTR2AHTR2C
SCHEMBL4076882 0.85 HTR2A (0.52) DRD2DRD3HTR1AHTR2AHTR7
Hydrochloric Acid SCHEMBL4076870 0.85 HTR1A (0.54) DRD2DRD3HTR1AHTR2AHTR7
Hydrochloric Acid SCHEMBL4076873 0.85 HTR1A (0.54) DRD2DRD3HTR1AHTR2AHTR7
SCHEMBL4076879 0.85 HTR2A (0.52) DRD2DRD3HTR1AHTR2AHTR7
Hydrochloric Acid SCHEMBL4081764 0.85 DRD3 (0.73) DRD2DRD3HTR2A
Hydrochloric Acid SCHEMBL4081759 0.85 DRD3 (0.73) DRD2DRD3HTR2A
Hydrochloric Acid SCHEMBL4084747 0.84 DRD2 (0.61) DRD2DRD3HTR1AHTR2AHTR7

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 3 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
US-7473692-B2 Sulfonamide derivatives as D3-receptor ligands RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2009-01-06 US disclosed