SCHEMBL29508627

SCHEMBL29508627

CS(=O)(=O)Oc1cccc(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 5/20 0.51
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ PTGS1 P23219 1/20 0.44
▸ PTGS2 P35354 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ OGG1 O15527 1/20 0.42
▸ ALPL P05186 1/20 0.42
▸ ALPI P09923 1/20 0.42
▸ PGR P06401 1/20 0.41

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
SCHEMBL17688536 1.00 NFE2L2 (0.51) NFE2L2CA1CA2CA9PTGS1
SCHEMBL3838916 0.85 CA2 (0.60) NFE2L2CA1CA2CA9ALDH1A1
SCHEMBL10558186 0.82 CA1 (0.47) NFE2L2CA1CA2CA9PTGS1
SCHEMBL17681373 0.80 CA1 (0.45) NFE2L2CA1CA2CA9PTGS1
SCHEMBL9451233 0.80 CA2 (0.73) CA1CA2CA9
SCHEMBL4431267 0.80 CA1 (0.45) NFE2L2CA1CA2CA9ALDH1A1
SCHEMBL9451243 0.79 RAB9A (0.63) NFE2L2CA1CA2CA9ALDH1A1
SCHEMBL30872943 0.78 CA2 (0.70) CA1CA2CA9
SCHEMBL4431265 0.78 CA2 (0.44) NFE2L2CA1CA2CA9ALDH1A1
SCHEMBL27182665 0.78 CA2 (0.70) CA1CA2CA9

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
WO-2023203066-A1 SYNERGISTIC ACTION AS NITRIFICATION INHIBITORS OF DCD OLIGOMERS WITH ALKOXYPYRAZOLE AND ITS OLIGOMERS BASF SE (DE) 2023-10-26 — — WO disclosed
EP-3993626-A1 HERBICIDAL COMPOSITIONS Bayer Aktiengesellschaft (DE) 2022-05-11 — — EP disclosed
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