SCHEMBL8519790

SCHEMBL8519790

NS(=O)(=O)Nc1ccc(O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 16/20 1.00
CA2 P00918 16/20 1.00
CA12 O43570 4/20 0.61
CA9 Q16790 4/20 0.61
KIF11 P52732 1/20 0.50
ALDH1A1 P00352 1/20 0.50
TP53 P04637 1/20 0.50
CYP3A4 P08684 1/20 0.50
THRB P10828 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
CASP1 P29466 1/20 0.50
RECQL P46063 1/20 0.50
HIF1A Q16665 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL9439925 0.80 CA2 (0.68) CA1CA2CA12CA9ALDH1A1
SCHEMBL5684413 0.78 CA1 (0.64) CA1CA2CA12CA9KIF11
SCHEMBL6352180 0.78 CA1 (0.64) CA1CA2CA12CA9KIF11
SCHEMBL4591628 0.78 CA1 (0.64) CA1CA2CA12CA9ALDH1A1
SCHEMBL1122831 0.76 CA1 (0.61) CA1CA2CA12CA9KIF11
SCHEMBL1645913 0.76 CA1 (1.00) CA1CA2CA12CA9KIF11
SCHEMBL28472964 0.76 CA2 (1.00) CA1CA2CA12CA9
SCHEMBL21033856 0.76 CA1 (0.61) CA1CA2CA12CA9ALDH1A1
SCHEMBL518114 0.76 CA1 (0.61) CA1CA2CA12CA9KIF11
SCHEMBL28750070 0.76 CA1 (1.00) CA1CA2CA12CA9KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115785018-A Preparation method of febuxostat decarboxylated impurities 湖北广济药业股份有限公司 2023-03-14 CN disclosed
CN-112961118-A Synthesis method of febuxostat decarboxylation impurities 廊坊师范学院 2021-06-15 CN disclosed
US-5932407-A COLOR PHOTOGRAPHY EASTMAN KODAK COMPANY (US) 1999-08-03 US disclosed
US-4525451-A COLOR STAIN INHIBITORS IN SILVER HALIDES FUJI PHOTO FILM CO., LTD. (JP) 1985-06-25 US disclosed