SCHEMBL4732376

SCHEMBL4732376

CC1(C)c2ccc(F)cc2S(=O)(=O)c2cc(S(=O)(=O)NC3CCNCC3)c(OC(F)(F)F)cc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WNT3 P56703 1/20 0.36
SFRP1 Q8N474 1/20 0.36
BRD4 O60885 2/20 0.36
BRD2 P25440 2/20 0.36
BRD3 Q15059 2/20 0.36
MCHR1 Q99705 3/20 0.33
ADRA2A P08913 2/20 0.33
NPY5R Q15761 2/20 0.33
HTR6 P50406 1/20 0.33
PI4KA P42356 1/20 0.33
PAX8 Q06710 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
ALPL P05186 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
DRD2 P14416 1/20 0.31
ADRA1D P25100 1/20 0.31
ADRA1A P35348 1/20 0.31
ADRA1B P35368 1/20 0.31
CXCR2 P25025 1/20 0.31
HDAC8 Q9BY41 1/20 0.31

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
SCHEMBL4797958 0.89 DRD2 (0.38) WNT3SFRP1BRD4BRD2BRD3
SCHEMBL4797961 0.87 BRD4 (0.36) WNT3SFRP1BRD4BRD2BRD3
SCHEMBL4733825 0.86 SFRP1 (0.46) WNT3SFRP1BRD4BRD2BRD3
SCHEMBL4735477 0.86 DPP4 (0.36) WNT3SFRP1HTR6DRD2
SCHEMBL4735151 0.84 BRD4 (0.35) WNT3SFRP1BRD4BRD2BRD3
SCHEMBL4730171 0.84 SFRP1 (0.42) WNT3SFRP1BRD4
SCHEMBL4731674 0.79 PTGDR2 (0.33)
SCHEMBL4730172 0.77 SFRP1 (0.42) WNT3SFRP1BRD4
SCHEMBL4737035 0.74 BRD4 (0.43) WNT3SFRP1BRD4BRD2BRD3
SCHEMBL4730889 0.72 SFRP1 (0.48) WNT3SFRP1BRD4BRD2BRD3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008061029-A1 ARYL SULFONAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-05-22 WO disclosed