SCHEMBL4783875

SCHEMBL4783875

CC(C)c1cccc2c1c(S(=O)(=O)NC1CCNCC1)cn2S(=O)(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 18/20 0.56
DRD2 P14416 2/20 0.43
DRD3 P35462 2/20 0.43
WNT3 P56703 1/20 0.42
SFRP1 Q8N474 1/20 0.42
HTR1A P08908 2/20 0.41
HTR7 P34969 2/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.40

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
SCHEMBL4782045 0.88 HTR6 (0.45) HTR6DRD2HTR1AHTR7HTR2A
SCHEMBL14207899 0.88 HTR6 (0.43) HTR6DRD2HTR1AHTR7HTR2A
SCHEMBL4784203 0.88 HTR6 (0.43) HTR6DRD2HTR1AHTR7HTR2A
SCHEMBL4802468 0.88 HTR1A (0.46) HTR6DRD2HTR1AHTR7HTR2A
SCHEMBL4784470 0.87 HTR6 (0.42) HTR6DRD2HTR1AHTR7HTR2A
SCHEMBL4784467 0.87 HTR6 (0.42) HTR6DRD2HTR1AHTR7HTR2A
SCHEMBL4781961 0.87 HTR6 (0.42) HTR6DRD2SFRP1HTR1AHTR7
SCHEMBL4784223 0.86 HTR1A (0.42) HTR6DRD2WNT3SFRP1HTR1A
SCHEMBL4782711 0.85 HTR6 (0.52) HTR6DRD2DRD3WNT3SFRP1
SCHEMBL14208209 0.85 HTR6 (0.54) HTR6DRD2DRD3WNT3SFRP1

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
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO claimed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed