SCHEMBL29054342

SCHEMBL29054342

O=S(=O)(O)c1ccc(F)c(F)c1S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 1/20 0.41
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CES2 O00748 2/20 0.37
CES1 P23141 2/20 0.37
CA12 O43570 1/20 0.37
CA7 P43166 1/20 0.37
CA13 Q8N1Q1 1/20 0.37
LMNA P02545 2/20 0.33
HSD17B10 Q99714 1/20 0.33
TTR P02766 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
BCHE P06276 1/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
COMT P21964 1/20 0.31
AURKA O14965 1/20 0.31
AURKB Q96GD4 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL29268497 0.86 CA1 (0.39) TET2CA1CA2CES2CES1
SCHEMBL3712172 0.84 CES2 (0.43) TET2CA1CA2CES2CES1
SCHEMBL29351017 0.84 CES2 (0.43) TET2CA1CA2CES2CES1
Hydrochloric Acid SCHEMBL27456921 0.82 LMNA (0.42) TET2CA1CA2CES2CES1
SCHEMBL22034264 0.78 TET2 (0.39) TET2CES2CES1LMNAHSD17B10
SCHEMBL10921837 0.77 TSHR (0.41) TET2LMNAHSD17B10TTRTSHR
SCHEMBL30427780 0.74 TET2 (0.39) TET2CES2CES1ALDH1A1
SCHEMBL10014826 0.74 TET2 (0.39) TET2CES2CES1LMNAHSD17B10
SCHEMBL29009769 0.74 TET2 (0.39) TET2CES2CES1ALDH1A1
SCHEMBL18700993 0.74 TET2 (0.36) TET2CES2CES1LMNAHSD17B10

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-116349679-A Composite disinfection and sterilization method 孙国明 2023-06-30 CN claimed
CN-116349679-A Composite disinfection and sterilization method 孙国明 2023-06-30 CN disclosed