SCHEMBL4735477

SCHEMBL4735477

CC1(C)c2ccc(F)cc2S(=O)(=O)c2cc(S(=O)(=O)NC3CCN(C(=O)O)CC3)c(OC(F)(F)F)cc21

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 8/20 0.36
DPP7 Q9UHL4 5/20 0.36
KCNH2 Q12809 4/20 0.36
DPP8 Q6V1X1 3/20 0.36
DPP9 Q86TI2 3/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
SFRP1 Q8N474 6/20 0.35
WNT3 P56703 3/20 0.35
HTR1A P08908 2/20 0.34
HTR7 P34969 2/20 0.34
EPHX2 P34913 2/20 0.34
DRD2 P14416 1/20 0.33
HTR6 P50406 1/20 0.33

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
SCHEMBL4730171 0.91 SFRP1 (0.42) CYP3A4CYP2C19SFRP1WNT3
SCHEMBL4733107 0.88 SFRP1 (0.43) SFRP1WNT3
SCHEMBL4730501 0.86 DPP4 (0.39) DPP4DPP7KCNH2DPP8DPP9
SCHEMBL4732376 0.86 WNT3 (0.36) SFRP1WNT3DRD2HTR6
SCHEMBL4730172 0.85 SFRP1 (0.42) CYP3A4CYP2C19SFRP1WNT3
SCHEMBL4734137 0.81 SFRP1 (0.43) SFRP1WNT3
SCHEMBL4730846 0.79 DPP4 (0.39) DPP4DPP7KCNH2DPP8DPP9
SCHEMBL4730237 0.76 MEN1 (0.39) CYP3A4CYP2C19SFRP1WNT3
SCHEMBL4731674 0.76 PTGDR2 (0.33)
SCHEMBL4731040 0.75 SFRP1 (0.42) DPP4DPP7KCNH2SFRP1HTR1A

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