SCHEMBL4732786

SCHEMBL4732786

COc1ccc(S(=O)(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c(C(F)(F)F)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.60
SFRP1 Q8N474 7/20 0.57
STS P08842 3/20 0.56
ALDH1A1 P00352 1/20 0.56
CCR8 P51685 1/20 0.52
WNT3 P56703 3/20 0.51
BRD4 O60885 1/20 0.49
MMP1 P03956 3/20 0.48
MMP3 P08254 3/20 0.48
MMP7 P09237 3/20 0.48
MMP9 P14780 3/20 0.48
MMP8 P22894 3/20 0.48
MMP13 P45452 3/20 0.48
MMP2 P08253 2/20 0.48
TGFBR1 P36897 1/20 0.47

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
SCHEMBL4734056 0.89 SFRP1 (0.48) EPHX2SFRP1WNT3
SCHEMBL4856222 0.89 SFRP1 (0.61) EPHX2SFRP1STSCCR8WNT3
SCHEMBL4883255 0.88 SFRP1 (0.59) EPHX2SFRP1STSCCR8WNT3
SCHEMBL4735664 0.87 SFRP1 (0.58) EPHX2SFRP1STSCCR8WNT3
SCHEMBL4876888 0.85 SFRP1 (0.56) SFRP1STSCCR8WNT3BRD4
SCHEMBL6103230 0.85 SFRP1 (0.76) SFRP1WNT3
SCHEMBL4799560 0.84 SFRP1 (0.62) SFRP1CCR8WNT3BRD4
SCHEMBL4734835 0.84 SFRP1 (0.56) EPHX2SFRP1STSCCR8WNT3
SCHEMBL4736604 0.84 SFRP1 (0.67) SFRP1STSCCR8WNT3BRD4
SCHEMBL4846943 0.84 SFRP1 (0.56) EPHX2SFRP1STSCCR8WNT3

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