SCHEMBL4733733

SCHEMBL4733733

CC(C)c1ccc(S(=O)(=O)NC2CCNCC2)c(C(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SFRP1 Q8N474 6/20 0.54
WNT3 P56703 2/20 0.54
BRD4 O60885 2/20 0.41
BRD2 P25440 2/20 0.41
BRD3 Q15059 2/20 0.41
CNR2 P34972 5/20 0.39
CNR1 P21554 1/20 0.39
CCR8 P51685 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
HTR1A P08908 2/20 0.38
HTR1D P28221 2/20 0.38
HTR1B P28222 2/20 0.38
HTR2C P28335 2/20 0.38
HTR7 P34969 2/20 0.38
HTR2B P41595 2/20 0.38
HTR6 P50406 2/20 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
SCHEMBL4733987 0.83 SFRP1 (0.58) SFRP1WNT3BRD4BRD2BRD3
SCHEMBL4735335 0.81 SFRP1 (0.57) SFRP1WNT3BRD4BRD2BRD3
SCHEMBL4735582 0.81 SFRP1 (0.57) SFRP1WNT3CNR2CNR1
SCHEMBL4733149 0.81 SFRP1 (0.48) SFRP1WNT3
SCHEMBL4734318 0.81 SFRP1 (0.54) SFRP1WNT3BRD4BRD2BRD3
SCHEMBL4731736 0.81 SFRP1 (0.54) SFRP1WNT3BRD4BRD2BRD3
SCHEMBL4730932 0.81 SFRP1 (0.52) SFRP1WNT3BRD4BRD2BRD3
Hydrochloric Acid SCHEMBL4733123 0.81 SFRP1 (0.56) SFRP1WNT3BRD4BRD2BRD3
SCHEMBL4783415 0.80 NR1H2 (0.41) CNR2CNR1
SCHEMBL4731294 0.80 SFRP1 (0.55) SFRP1WNT3CNR2CCR8

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