SCHEMBL28886166

SCHEMBL28886166

C=Cc1ccc(S(=O)(=O)ON(C2CCCCC2)C2CCCCC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.42
SERPINE1 P05121 1/20 0.36
ALDH1A1 P00352 4/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 2/20 0.35
GAA P10253 2/20 0.34
LMNA P02545 1/20 0.34
ESR1 P03372 1/20 0.34
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TRPM8 Q7Z2W7 2/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL9677450 0.80 POLB (0.54) ALDH1A1KMT2AKDM4EMEN1POLB
SCHEMBL5691471 0.78 TDP1 (0.44) TDP1ALDH1A1KDM4EHCRTR1HCRTR2
SCHEMBL8949546 0.77 ENPP3 (0.49) ALDH1A1KMT2AMEN1LMNA
SCHEMBL21990643 0.74 TDP1 (0.60) TDP1SERPINE1ALDH1A1KMT2AKDM4E
SCHEMBL11672865 0.71 TDP1 (0.55) TDP1ALDH1A1KDM4EGAALMNA
SCHEMBL4564767 0.70 TDP1 (0.50) TDP1ALDH1A1POLBLMNAHCRTR1
SCHEMBL25862528 0.70 TDP1 (0.46) TDP1ALDH1A1KMT2AMEN1POLB
SCHEMBL14382794 0.70 TDP1 (0.46) TDP1ALDH1A1KMT2AKDM4EMEN1
SCHEMBL29323838 0.70 TDP1 (0.46) TDP1ALDH1A1KMT2AKDM4EMEN1
SCHEMBL6115133 0.70 TDP1 (0.53) TDP1ALDH1A1LMNAHCRTR1HCRTR2

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-110997631-B High purity amphiphilic arylsulfonic acid amine salt vinyl monomers and (co) polymers thereof 东曹精细化工株式会社 2022-07-15 CN disclosed
CN-110997631-A High purity amphiphilic arylsulfonic acid amine salt vinyl monomers and (co) polymers thereof 东曹精细化工株式会社 2020-04-10 CN disclosed