SCHEMBL28050184

SCHEMBL28050184

O=C(CS(=O)(=O)C(F)F)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 7/20 0.49
RECQL P46063 2/20 0.49
MAPK1 P28482 2/20 0.48
MAPT P10636 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
MEN1 O00255 2/20 0.48
CYP3A4 P08684 2/20 0.48
HPGD P15428 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALOX15 P16050 1/20 0.48
CES1 P23141 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TSHR P16473 1/20 0.46
ALDH1A1 P00352 3/20 0.45
GSK3B P49841 2/20 0.45
PTPN1 P18031 2/20 0.45
HIF1A Q16665 2/20 0.45
TRPA1 O75762 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44

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
SCHEMBL28003830 0.78 RECQL (0.50) HSD11B1RECQLMAPK1MAPTTDP1
SCHEMBL29236675 0.78 HSD11B1 (0.73) HSD11B1RECQLMAPK1MEN1HPGD
SCHEMBL7149069 0.78 MAPK1 (0.54) HSD11B1RECQLMAPK1MAPTTDP1
SCHEMBL260911 0.78 ALDH1A1 (0.56) HSD11B1RECQLMAPK1MAPTTDP1
SCHEMBL1516246 0.77 MAPK1 (0.58) HSD11B1RECQLMAPK1MAPTTDP1
SCHEMBL28538199 0.77 RECQL (0.49) HSD11B1RECQLMAPK1MAPTTDP1
SCHEMBL137832 0.75 MAPK1 (0.56) HSD11B1RECQLMAPK1MAPTTDP1
SCHEMBL7868384 0.74 MAPK1 (0.54) HSD11B1RECQLMAPK1MAPTTDP1
SCHEMBL2188285 0.74 MAPT (0.54) HSD11B1RECQLMAPK1MAPTTDP1
SCHEMBL544367 0.74 MAPK1 (0.54) HSD11B1RECQLMAPK1MAPTTDP1

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
CN-105399649-A Synthetic method for 2-difluoromethylsulfonylacetophenone UNIV CHANGZHOU 2016-03-16 CN disclosed
CN-105399649-A Synthetic method for 2-difluoromethylsulfonylacetophenone UNIV CHANGZHOU 2016-03-16 CN disclosed