SCHEMBL28312438

SCHEMBL28312438

O=Cc1c(F)cccc1S(=O)(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.47
KMT2A Q03164 1/20 0.46
HTT P42858 2/20 0.44
TSHR P16473 1/20 0.44
HSD11B1 P28845 1/20 0.42
HTR2A P28223 4/20 0.41
HTR2C P28335 2/20 0.41
KCNH2 Q12809 1/20 0.41
GAA P10253 2/20 0.40
ALDH1A1 P00352 1/20 0.40
NFE2L2 Q16236 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA13 Q8N1Q1 1/20 0.40
POLB P06746 1/20 0.39
GFER P55789 1/20 0.39
CNR2 P34972 1/20 0.38

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
SCHEMBL29058018 0.85 ALDH1A1 (0.47) KMT2AHSD11B1HTR2AHTR2CKCNH2
SCHEMBL29058012 0.82 NFE2L2 (0.48) KMT2AHSD11B1HTR2AHTR2CKCNH2
SCHEMBL30394880 0.82 FEN1 (0.44) HTR6KMT2AHTR2AHTR2CKCNH2
SCHEMBL29057994 0.82 HSD11B1 (0.50) HTR6HSD11B1CNR2
SCHEMBL29058016 0.82 FEN1 (0.44) HTR6KMT2AHTR2AHTR2CKCNH2
SCHEMBL29057960 0.81 PKM (0.51) KMT2AHSD11B1GAANFE2L2
SCHEMBL776706 0.81 HTR6 (0.57) HTR6KMT2AHTTTSHRHSD11B1
SCHEMBL545481 0.79 HTR6 (0.52) HTR6KMT2AHTTTSHRHSD11B1
SCHEMBL29057907 0.79 NFE2L2 (0.51) HTR6KMT2ATSHRGAANFE2L2
SCHEMBL3974600 0.77 TSHR (0.50) HTR6KMT2AHTTTSHRHTR2A

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-110117264-B Phenyl sulfone derivative and application thereof in medicines 广东东阳光药业有限公司 2023-06-09 CN disclosed
CN-110117264-A Phenyl sulfone derivative and its application on drug 广东东阳光药业有限公司 2019-08-13 CN disclosed