SCHEMBL25681971

SCHEMBL25681971

C=Cc1ccc(S(=O)(=O)N(C)OS(=O)(=O)C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
ATM Q13315 1/20 0.34
LMNA P02545 3/20 0.33
NR1H3 Q13133 3/20 0.33
ALDH1A1 P00352 2/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NR1H2 P55055 2/20 0.32
NPC1 O15118 1/20 0.31
GAA P10253 1/20 0.31
CA2 P00918 1/20 0.31
AGER Q15109 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
FFAR1 O14842 1/20 0.31
CA12 O43570 1/20 0.30
CA9 Q16790 1/20 0.30
HTR2A P28223 1/20 0.30

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
SCHEMBL25862528 0.81 TDP1 (0.46) TDP1ATMLMNAALDH1A1HTT
SCHEMBL17545697 0.77 TDP1 (0.44) TDP1ATMLMNANR1H3ALDH1A1
SCHEMBL25681981 0.76
SCHEMBL943450 0.74 TDP1 (0.42) TDP1LMNAALDH1A1CA2CA9
SCHEMBL19389695 0.73 TDP1 (0.55) TDP1ATMLMNAALDH1A1HTT
SCHEMBL1494554 0.73 TDP1 (0.55) TDP1ATMLMNAALDH1A1HTT
Hydrogen Sulfide SCHEMBL29027315 0.73 TDP1 (0.41) TDP1LMNAALDH1A1CA2CA9
SCHEMBL17545747 0.71 TDP1 (0.40) TDP1LMNAALDH1A1HTTGAA
SCHEMBL20906806 0.70 TDP1 (0.55) TDP1LMNAALDH1A1HTTSMN1; SMN2
SCHEMBL6081250 0.67 CXCR2 (0.36) TDP1ALDH1A1CA2CA9

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023090665-A1 NOVEL ADDITIVE FOR NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY COMPRISING SAME 주식회사 엘지에너지솔루션 2023-05-25 WO disclosed