SCHEMBL4617246

SCHEMBL4617246

O=C(NS(=O)(=O)c1cc([S+]([O-])c2ccccc2)ccc1C(F)(F)F)C1CCNCC1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SFRP1 Q8N474 19/20 0.49
WNT3 P56703 6/20 0.49
ALKBH2 Q6NS38 1/20 0.39
ALKBH3 Q96Q83 1/20 0.39
FTO Q9C0B1 1/20 0.39

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
SCHEMBL4617253 0.82 SFRP1 (0.72) SFRP1WNT3
SCHEMBL4617230 0.70 SFRP1 (0.63) SFRP1WNT3
SCHEMBL16863987 0.67 ALKBH2 (0.34) ALKBH2ALKBH3FTO
SCHEMBL4725927 0.67 SFRP1 (0.77) SFRP1WNT3
SCHEMBL4618018 0.66 SFRP1 (1.00) SFRP1WNT3
SCHEMBL2925179 0.66 STS (0.62)
Hydrochloric Acid SCHEMBL18248667 0.65 SFRP1 (0.98) SFRP1WNT3
SCHEMBL6102520 0.65 SFRP1 (1.00) SFRP1WNT3
SCHEMBL1817247 0.65 POLB (0.61)
SCHEMBL4616514 0.64 SFRP1 (0.72) SFRP1WNT3

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
EP-1879859-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF Wyeth a Corporation of the State of Delaware (US) 2008-01-23 EP disclosed
WO-2006124875-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF WYETH (US) 2006-11-23 WO disclosed