SCHEMBL11096804

SCHEMBL11096804

CCCCCCS(=O)(=O)c1cc(NCc2ccco2)c(S(=O)(=O)Oc2ccccc2)cc1S(N)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 6/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ CA2 P00918 3/20 0.42
▸ CA12 O43570 2/20 0.42
▸ CA1 P00915 2/20 0.42
▸ CA6 P23280 2/20 0.42
▸ CA5A P35218 2/20 0.42
▸ CA7 P43166 2/20 0.42
▸ CA14 Q9ULX7 2/20 0.42
▸ HTR1A P08908 1/20 0.42
▸ CA4 P22748 1/20 0.42
▸ HSD11B1 P28845 1/20 0.42
▸ SLC10A1 Q14973 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ GPR35 Q9HC97 1/20 0.42
▸ CISD1 Q9NZ45 1/20 0.42
▸ ABCG2 Q9UNQ0 1/20 0.42
▸ CA5B Q9Y2D0 1/20 0.42
▸ AQP1 P29972 1/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36

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
SCHEMBL11099810 0.93 ALDH1A1 (0.45) APPALDH1A1CA2CA12CA1
SCHEMBL11104379 0.85 ALDH1A1 (0.48) APPALDH1A1CA2CA12CA1
SCHEMBL10964924 0.85 ALDH1A1 (0.46) APPALDH1A1CA2CA12CA1
Potassium Ion SCHEMBL11099985 0.84 ALDH1A1 (0.43) APPALDH1A1CA2CA12CA1
SCHEMBL11100981 0.84 ALDH1A1 (0.43) APPALDH1A1CA2CA12CA1
Potassium Ion SCHEMBL11098727 0.83 ALDH1A1 (0.44) APPALDH1A1CA2CA12CA1
SCHEMBL11101209 0.83 ALDH1A1 (0.44) APPALDH1A1CA2CA12CA1
SCHEMBL10968089 0.81 ALDH1A1 (0.48) APPALDH1A1CA2CA12CA1
Potassium Ion SCHEMBL11103412 0.81 ALDH1A1 (0.45) APPALDH1A1CA2CA12CA1
SCHEMBL11099270 0.80 ALDH1A1 (0.42) APPALDH1A1CA2CA12CA1

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
EP-0034746-B1 5-SULFAMOYL-ORTHANILIC ACIDS, PROCESSES FOR THEIR PREPARATION, THERAPEUTIC COMPOSITIONS CONTAINING THEM AND THE COMPOUNDS FOR USE IN THERAPY HOECHST AKTIENGESELLSCHAFT (DE) 1984-01-18 — — EP disclosed
US-4339446-A 5-Sulfamoyl-orthanilic acids, processes for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1982-07-13 — — US disclosed
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