SCHEMBL23010333

SCHEMBL23010333

Cc1cc(F)c(C)c([S+]([O-])Cl)c1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC6 Q9UBN7 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
SCHEMBL23010371 0.73 RAPGEF4 (0.34) HDAC1HDAC6
SCHEMBL30668 0.71 HDAC1 (0.48) NFE2L2HDAC1HDAC6
SCHEMBL23010362 0.69
SCHEMBL20084813 0.68 CCR1 (0.32)
SCHEMBL21572413 0.68 CCR1 (0.32)
Nitrogen SCHEMBL10699058 0.66 HDAC1 (0.44) NFE2L2HDAC1HDAC6
SCHEMBL764794 0.66 RAPGEF4 (0.37) NFE2L2HDAC1HDAC6
SCHEMBL4137547 0.65 RAPGEF4 (0.32)
SCHEMBL18680691 0.65 CA3 (0.39) NFE2L2
SCHEMBL1056730 0.64 RAPGEF4 (0.43) NFE2L2HDAC1HDAC6

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-4013495-B1 ARYLSULFONAMIDE DERIVATIVES AS MGLUR4 NEGATIVE ALLOSTERIC MODULATORS HOFFMANN LA ROCHE (CH) 2023-09-27 EP disclosed
WO-2021028512-A1 ARYLSULFONAMIDE DERIVATIVES AS MGLUR4 NEGATIVE ALLOSTERIC MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2021-02-18 WO disclosed