SCHEMBL6501982

SCHEMBL6501982

COc1cc2c(cc1S(=O)(=O)c1ccc(N3CCN(c4cccc(Cl)c4Cl)CC3)cc1)CCN(C)CC2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.47
DRD3 P35462 3/20 0.47
HTR1A P08908 2/20 0.44
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
HTR6 P50406 4/20 0.42
HTR2A P28223 3/20 0.41
HTR2C P28335 2/20 0.41
LMNA P02545 5/20 0.41
MAPT P10636 3/20 0.41
TSHR P16473 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HSD17B10 Q99714 2/20 0.40
HTT P42858 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
USP2 O75604 1/20 0.39
GLA P06280 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL6506073 0.93 LMNA (0.44) DRD2DRD3HTR1AHTR1DHTR1B
SCHEMBL6511504 0.87 DRD2 (0.52) DRD2DRD3HTR1ALMNAMAPT
SCHEMBL6501509 0.86 HTR6 (0.46) DRD2DRD3HTR6HTR2AHTR2C
SCHEMBL6504564 0.86 HTR6 (0.54) DRD2DRD3HTR1AHTR1DHTR1B
SCHEMBL6500166 0.85 HTR1A (0.43) DRD2DRD3HTR1AHTR1DHTR1B
SCHEMBL6508620 0.85 MAPT (0.49) DRD2DRD3HTR6HTR2AHTR2C
SCHEMBL6502583 0.85 LMNA (0.48) DRD2DRD3HTR6HTR2AHTR2C
SCHEMBL6500224 0.84 ALDH1A1 (0.50) DRD2DRD3HTR1AHTR1DHTR1B
SCHEMBL6507562 0.83 MAPT (0.57) DRD2HTR1AHTR1DHTR1BHTR6
SCHEMBL6500880 0.82 LMNA (0.51) DRD2DRD3HTR6LMNAMAPT

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
WO-2005014578-A1 PHENYLSULFONYL COMPOUNDS AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2005-02-17 WO claimed
WO-2005014578-A1 PHENYLSULFONYL COMPOUNDS AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2005-02-17 WO disclosed