SCHEMBL11165084

SCHEMBL11165084

NS(=O)(=O)c1cc(C(=O)OCc2ccccc2)c(Cl)cc1Cl

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.70
▸ CA1 P00915 17/20 0.62
▸ CA2 P00918 17/20 0.62
▸ CA9 Q16790 17/20 0.62
▸ CA12 O43570 16/20 0.62
▸ CA3 P07451 7/20 0.62
▸ CA4 P22748 7/20 0.62
▸ CA6 P23280 7/20 0.62
▸ CA7 P43166 7/20 0.62
▸ CA13 Q8N1Q1 7/20 0.62
▸ CA14 Q9ULX7 7/20 0.62
▸ CA5B Q9Y2D0 7/20 0.62
▸ CA5A P35218 5/20 0.62
▸ CISD1 Q9NZ45 2/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.51

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
SCHEMBL4132618 0.83 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2TDP1
SCHEMBL10829304 0.79 CA1 (0.77) ALDH1A1CA1CA2CA9CA12
SCHEMBL230206 0.78 CA12 (0.73) ALDH1A1CA1CA2CA9CA12
SCHEMBL18424707 0.77 CA1 (0.67) ALDH1A1CA1CA2CA9CA12
SCHEMBL24152237 0.75 ALDH1A1 (0.54) ALDH1A1TDP1
SCHEMBL31448226 0.75 ALDH1A1 (0.54) ALDH1A1TDP1
SCHEMBL5063447 0.75 CHRM2 (0.54) ALDH1A1TDP1
SCHEMBL7228486 0.75 TSHR (0.47) ALDH1A1CA1CA2CA9CA12
SCHEMBL31670552 0.75 CA12 (0.71) CA1CA2CA9CA12CA3
SCHEMBL8555147 0.75 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-58192863-A — — None — — JP disclosed
JP-S58192863-A NOVEL AMINOSULFONYLBENZOIC ACID ESTER DERIVATIVE HODOGAYA CHEM CO LTD 1983-11-10 — — JP disclosed
EP-0068407-A1 Aminosulfonylbenzoic acid derivatives HODOGAYA CHEMICAL CO., LTD. (JP) 1983-01-05 — — EP disclosed
Send feedback