SCHEMBL7920821

SCHEMBL7920821

NS(=O)(=O)c1nc2[nH]c(=O)[nH]c(=O)c2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.52
▸ ALDH1A1 P00352 2/20 0.51
▸ HSD17B10 Q99714 2/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ XDH P47989 3/20 0.47
▸ ADORA2B P29275 2/20 0.44
▸ GDA Q9Y2T3 2/20 0.39
▸ ACHE P22303 1/20 0.39
▸ RPS6KA3 P51812 1/20 0.37
▸ CA1 P00915 3/20 0.33
▸ CA2 P00918 3/20 0.33
▸ CA9 Q16790 3/20 0.33
▸ BLM P54132 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ PABPC1 P11940 1/20 0.33

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
SCHEMBL29600264 0.81 MAPT (0.47) MAPTALDH1A1HSD17B10CYP3A4HPGD
SCHEMBL447389 0.72 MAPT (0.84) MAPTALDH1A1HSD17B10CYP3A4HPGD
Hydrochloric Acid SCHEMBL7296117 0.71 MAPT (0.81) MAPTALDH1A1HSD17B10CYP3A4HPGD
SCHEMBL22144 0.68 MAPT (1.00) MAPTALDH1A1HSD17B10HPGDALOX15
Uric Acid SCHEMBL2786719 0.68 MAPT (0.53) MAPTALDH1A1HSD17B10CYP3A4HPGD
SCHEMBL932949 0.68 MAPT (0.53) MAPTALDH1A1HSD17B10CYP3A4HPGD
SCHEMBL2837685 0.68 MAPT (0.53) MAPTALDH1A1HSD17B10CYP3A4HPGD
SCHEMBL932609 0.68 MAPT (0.53) MAPTALDH1A1HSD17B10CYP3A4HPGD
SCHEMBL29737686 0.68 MAPT (0.53) MAPTALDH1A1HSD17B10CYP3A4HPGD
SCHEMBL740931 0.68 MAPT (0.53) MAPTALDH1A1HSD17B10CYP3A4HPGD

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-6221874-B1 7-CYCLIC-SUBSTITUTED SULFONYL-3,7-DIHYDRO-PURINE-2, 6-DIONE DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION 2001-04-24 — — US disclosed
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