SCHEMBL4734739

SCHEMBL4734739

O=C(c1ccncc1)N1CCC(NS(=O)(=O)c2cc3c(cc2Cl)C2(CCCCC2)c2ccc(F)cc2S3(=O)=O)CC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SFRP1 Q8N474 9/20 0.43
WNT3 P56703 1/20 0.39
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
PKLR P30613 2/20 0.37
EPHX2 P34913 4/20 0.35
CYP3A4 P08684 1/20 0.35
DPP4 P27487 1/20 0.34
KCNH2 Q12809 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
CCR8 P51685 1/20 0.34
EPHX1 P07099 1/20 0.34

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
SCHEMBL4734889 0.92 SFRP1 (0.47) SFRP1PKLREPHX2CYP3A4LMNA
SCHEMBL4732377 0.82 WNT3 (0.34) SFRP1WNT3GAAEPHX2CYP3A4
SCHEMBL4734205 0.82 SFRP1 (0.43) SFRP1POLBPKLREPHX2MAPT
SCHEMBL4730886 0.82 MEN1 (0.36) SFRP1POLBCYP3A4LMNATP53
SCHEMBL4734307 0.78 SFRP1 (0.47) SFRP1PKLREPHX2CYP3A4LMNA
SCHEMBL4730501 0.77 DPP4 (0.39) SFRP1POLBEPHX2CYP3A4DPP4
SCHEMBL4801378 0.77 KDM4E (0.39) SFRP1KDM4EPOLBGAACYP3A4
SCHEMBL4730880 0.76 MEN1 (0.36) SFRP1POLBCYP3A4LMNATP53
SCHEMBL4733498 0.73 EPHX2 (0.40) SFRP1POLBEPHX2DPP4KCNH2
SCHEMBL4731040 0.72 SFRP1 (0.42) SFRP1POLBEPHX2DPP4KCNH2

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 claimed