SCHEMBL11547756

SCHEMBL11547756

CCCCc1c(N2CCC(C)C2)cc(C(=O)O)cc1S(N)(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ USP2 O75604 3/20 0.41
▸ HPGD P15428 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ HIF1A Q16665 2/20 0.41
▸ SLC6A4 P31645 1/20 0.41
▸ GAA P10253 4/20 0.39
▸ POLB P06746 2/20 0.39
▸ NR4A1 P22736 1/20 0.39
▸ CA2 P00918 4/20 0.38
▸ TSHR P16473 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ SLC12A2 P55011 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ LIPE Q05469 1/20 0.36
▸ CA12 O43570 3/20 0.36
▸ CA1 P00915 3/20 0.36
▸ CA9 Q16790 3/20 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
SCHEMBL11544500 0.85 KDM4E (0.53) ALDH1A1KDM4EHSD17B10USP2HPGD
SCHEMBL11545540 0.84 ALDH1A1 (0.47) ALDH1A1KDM4EHSD17B10USP2HPGD
SCHEMBL11542804 0.84 ALDH1A1 (0.46) ALDH1A1KDM4EHSD17B10USP2HPGD
SCHEMBL11542637 0.83 ALDH1A1 (0.48) ALDH1A1KDM4EHSD17B10USP2HPGD
SCHEMBL11544486 0.83 ALDH1A1 (0.41) ALDH1A1KDM4EHSD17B10USP2HPGD
SCHEMBL11548139 0.82 ALDH1A1 (0.47) ALDH1A1KDM4EHSD17B10USP2HPGD
SCHEMBL11543847 0.81 KDM4E (0.42) ALDH1A1KDM4EHSD17B10USP2HPGD
SCHEMBL11545605 0.80 ALDH1A1 (0.45) ALDH1A1KDM4EHSD17B10USP2HPGD
SCHEMBL11543283 0.80 KDM4E (0.40) ALDH1A1KDM4EHSD17B10USP2HPGD
SCHEMBL11543553 0.79 ALDH1A1 (0.49) ALDH1A1KDM4EHSD17B10USP2HPGD

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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