SCHEMBL17196470

SCHEMBL17196470

CCc1ncc(S(C)(=O)=O)cc1N1CC(F)(F)C1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.33
GPR119 Q8TDV5 6/20 0.32
RIPK1 Q13546 1/20 0.31
KIF18A Q8NI77 1/20 0.31

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
SCHEMBL21089018 0.87 ALOX5 (0.32) CNR2
SCHEMBL17177771 0.83 PDE10A (0.33) CNR2GPR119KIF18A
SCHEMBL17196425 0.72 HRH4 (0.36)
SCHEMBL16511461 0.69 ALDH1A1 (0.45)
SCHEMBL17196402 0.69 S100A9 (0.32)
SCHEMBL17196389 0.67 HTT (0.37)
SCHEMBL17196466 0.66 LRRK2 (0.38)
SCHEMBL24587389 0.63 NR1H2 (0.37) CNR2
SCHEMBL17173648 0.63 PTGS2 (0.37) GPR119KIF18A
SCHEMBL17177764 0.62 HRH4 (0.39)

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-2015158427-A1 HETEROARYL SUBSTITUTED HETEROCYCLYL SULFONES Grünenthal GmbH (DE) 2015-10-22 WO disclosed