SCHEMBL11215820

SCHEMBL11215820

NS(=O)(=O)c1cc(S(=O)(=O)Oc2ccccc2)c(NCc2cccs2)cc1S(=O)(=O)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CISD1 Q9NZ45 1/20 0.43
▸ CA12 O43570 4/20 0.38
▸ CA1 P00915 4/20 0.38
▸ CA2 P00918 4/20 0.38
▸ CA3 P07451 4/20 0.38
▸ CA4 P22748 4/20 0.38
▸ CA6 P23280 4/20 0.38
▸ CA5A P35218 4/20 0.38
▸ CA7 P43166 4/20 0.38
▸ CA9 Q16790 4/20 0.38
▸ CA13 Q8N1Q1 4/20 0.38
▸ CA14 Q9ULX7 4/20 0.38
▸ CA5B Q9Y2D0 4/20 0.38
▸ PDE4D Q08499 1/20 0.37
▸ PDE3A Q14432 1/20 0.37
▸ HPGD P15428 2/20 0.35
▸ PTGS2 P35354 2/20 0.34
▸ POLB P06746 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL11098356 0.99 CISD1 (0.43) CISD1CA12CA1CA2CA3
SCHEMBL11104031 0.87 CA12 (0.48) CISD1CA12CA1CA2CA3
SCHEMBL11097101 0.84 CISD1 (0.44) CISD1CA12CA1CA2CA3
SCHEMBL11100547 0.84 CISD1 (0.44) CISD1CA12CA1CA2CA3
SCHEMBL11096601 0.84 ALDH1A1 (0.43) CISD1CA12CA1CA2CA3
SCHEMBL11101859 0.84 ALDH1A1 (0.43) CISD1CA12CA1CA2CA3
SCHEMBL11101179 0.83 CISD1 (0.45) CISD1CA12CA1CA2CA3
SCHEMBL11104381 0.83 ALDH1A1 (0.43) CISD1CA12CA1CA2CA3
SCHEMBL11555157 0.80 CISD1 (0.48) CISD1CA1CA2CA4CA9
SCHEMBL11223169 0.76 CISD1 (0.46) CISD1CA1CA2PDE4DPDE3A

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
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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