SCHEMBL11546298

SCHEMBL11546298

NS(=O)(=O)c1ccc(-c2c(N3CCCC3)cc(C(=O)O)cc2S(N)(=O)=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.57
▸ HSD17B10 Q99714 2/20 0.57
▸ ALDH1A1 P00352 2/20 0.57
▸ USP2 O75604 1/20 0.57
▸ LMNA P02545 1/20 0.57
▸ HPGD P15428 1/20 0.57
▸ SLC6A4 P31645 1/20 0.57
▸ HIF1A Q16665 1/20 0.57
▸ CA1 P00915 11/20 0.48
▸ CA2 P00918 11/20 0.48
▸ CA9 Q16790 11/20 0.48
▸ CA12 O43570 7/20 0.48
▸ CA14 Q9ULX7 7/20 0.48
▸ CA7 P43166 3/20 0.44
▸ CA3 P07451 1/20 0.44
▸ CA6 P23280 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ CA5A P35218 1/20 0.44
▸ CA5B Q9Y2D0 1/20 0.44
▸ GAA P10253 3/20 0.42

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
SCHEMBL11547136 0.90 KDM4E (0.65) KDM4EHSD17B10ALDH1A1USP2LMNA
SCHEMBL11543459 0.89 KDM4E (0.64) KDM4EHSD17B10ALDH1A1USP2LMNA
SCHEMBL11545370 0.80 ALDH1A1 (0.83) KDM4EHSD17B10ALDH1A1USP2LMNA
SCHEMBL11548776 0.78 KDM4E (0.62) KDM4EHSD17B10ALDH1A1USP2LMNA
SCHEMBL11541751 0.77 KDM4E (0.60) KDM4EHSD17B10ALDH1A1USP2LMNA
SCHEMBL11545046 0.77 KDM4E (0.64) KDM4EHSD17B10ALDH1A1USP2LMNA
SCHEMBL11547078 0.77 KDM4E (0.64) KDM4EHSD17B10ALDH1A1USP2LMNA
SCHEMBL11543081 0.76 KDM4E (0.55) KDM4EHSD17B10ALDH1A1USP2LMNA
SCHEMBL11545473 0.76 KDM4E (0.63) KDM4EHSD17B10ALDH1A1USP2LMNA
SCHEMBL9436740 0.75 KDM4E (0.64) KDM4EHSD17B10ALDH1A1USP2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4161531-A Diuretic and saluretic 5-sulfamoylbenzoic acid derivatives carrying a heterocyclic substituent HOECHST AKTIENGESELLSCHAFT (DE) 1979-07-17 — — US disclosed
US-4118397-A DIURETICS HOECHST AKTIENGESELLSCHAFT (DE) 1978-10-03 — — US disclosed
US-4111953-A DIURETICS HOECHST AKTIENGESELLSCHAFT (DE) 1978-09-05 — — US disclosed
US-4093735-A DIURETICS HOECHST AKTIENGESELLSCHAFT (DT) 1978-06-06 — — US disclosed
US-4010273-A DIURETICS, SALURETICS HOECHST AKTIENGESELLSCHAFT (DT) 1977-03-01 — — US disclosed
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