SCHEMBL4731323

SCHEMBL4731323

O=S(=O)(NC1CCNCC1)c1ccc(-c2cccs2)cc1C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SFRP1 Q8N474 6/20 0.53
WNT3 P56703 2/20 0.53
ALOX5AP P20292 1/20 0.41
FEN1 P39748 1/20 0.41
BRD4 O60885 3/20 0.41
BRD2 P25440 2/20 0.41
BRD3 Q15059 2/20 0.41
HDAC3 O15379 3/20 0.40
HDAC1 Q13547 3/20 0.40
HDAC2 Q92769 3/20 0.40
ERN1 O75460 1/20 0.39
CCR8 P51685 1/20 0.39
GHSR Q92847 1/20 0.38
ALDH1A1 P00352 1/20 0.38
NR1H2 P55055 1/20 0.38

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
SCHEMBL4732944 0.84 SFRP1 (0.62) SFRP1WNT3ALOX5APFEN1BRD4
SCHEMBL4737736 0.83 SFRP1 (0.48) SFRP1WNT3
SCHEMBL4732044 0.81 SFRP1 (0.53) SFRP1WNT3ALOX5APFEN1BRD4
SCHEMBL4784510 0.81 SFRP1 (0.53) SFRP1WNT3ALOX5APFEN1BRD4
SCHEMBL4735520 0.80 SFRP1 (0.55) SFRP1WNT3ALOX5APFEN1BRD4
SCHEMBL4735299 0.80 SFRP1 (0.54) SFRP1WNT3ALOX5APFEN1BRD4
SCHEMBL4735337 0.80 SFRP1 (0.54) SFRP1WNT3ALOX5APFEN1BRD4
SCHEMBL4732022 0.80 SFRP1 (0.54) SFRP1WNT3ALOX5APFEN1BRD4
SCHEMBL4733987 0.79 SFRP1 (0.58) SFRP1WNT3BRD4BRD2BRD3
SCHEMBL4736497 0.79 SFRP1 (0.55) SFRP1WNT3BRD4HDAC3HDAC1

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-2008061016-A1 N-SUBSTITUTED PIPERIDINYL 4 -ARYLSULFONAMIDES AS MODULATORS OF THE SECRETED FRIZZLED RELATED PROTEIN- 1 WYETH (US) 2008-05-22 WO claimed
WO-2008061016-A1 N-SUBSTITUTED PIPERIDINYL 4 -ARYLSULFONAMIDES AS MODULATORS OF THE SECRETED FRIZZLED RELATED PROTEIN- 1 WYETH (US) 2008-05-22 WO disclosed