SCHEMBL28779173

SCHEMBL28779173

O=S(=O)(O)N(Cl)S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA5A P35218 2/20 0.39
CA5B Q9Y2D0 2/20 0.39
TSHR P16473 3/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
NT5E P21589 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 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
SCHEMBL17799282 0.72
SCHEMBL29895058 0.72
SCHEMBL4582111 0.72
SCHEMBL9736289 0.72
Sulfuric Acid SCHEMBL28487180 0.66 CA5A (0.86) CA5ACA5BTSHRCA1CA2
Sulfuric Acid SCHEMBL29861157 0.66
Sulfuric Acid SCHEMBL4727169 0.66 CA5A (0.86) CA5ACA5BTSHRCA1CA2
Sulfuric Acid SCHEMBL36481 0.66
SCHEMBL6890356 0.64 CA5A (0.46) CA5ACA5BTSHRCA1CA2
SCHEMBL29079969 0.64

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
CN-108325366-B Composition for preventing and eliminating odor 奥克希科学公司 2022-06-07 CN disclosed