Catechol

Catechol

SCHEMBL28036086

Oc1ccccc1O.[Hg].c1ccccc1

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.83
ALDH1A1 P00352 5/20 0.83
HPGD P15428 4/20 0.83
CA4 P22748 4/20 0.83
CA12 O43570 4/20 0.83
CA14 Q9ULX7 4/20 0.83
TDP1 Q9NUW8 3/20 0.83
HSD17B10 Q99714 3/20 0.83
ALOX15 P16050 3/20 0.83
KDM4E B2RXH2 3/20 0.83
LMNA P02545 3/20 0.83
SMN1; SMN2 Q16637 3/20 0.83
CA3 P07451 2/20 0.83
EGFR P00533 2/20 0.83
FYN P06241 2/20 0.83
MMP9 P14780 2/20 0.83
RECQL P46063 2/20 0.83
NPC1 O15118 2/20 0.83
MAPT P10636 2/20 0.83
GMNN O75496 1/20 0.83

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
Catechol SCHEMBL27822930 0.96
Catechol SCHEMBL27924351 0.96 CA2 (0.91) CA2ALDH1A1HPGDCA4CA12
Catechol SCHEMBL22028465 0.96 CA2 (0.91) CA2ALDH1A1HPGDCA4CA12
Catechol SCHEMBL11672589 0.91 ALDH1A1 (1.00) CA2ALDH1A1HPGDCA4CA12
Catechol SCHEMBL18351 0.91
Catechol SCHEMBL30944695 0.91 ALDH1A1 (1.00) CA2ALDH1A1HPGDCA4CA12
Catechol SCHEMBL367675 0.91 ALDH1A1 (1.00) CA2ALDH1A1HPGDCA4CA12
Catechol SCHEMBL30088487 0.91
Catechol SCHEMBL29352716 0.91
Catechol SCHEMBL25313512 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110003118-A The method for preparing carboxylic ester derivative 阿达玛马克西姆股份有限公司 2019-07-12 CN disclosed
CN-108882704-A Molecule with desinsection effectiveness, and intermediate relevant to these molecules, composition and method 美国陶氏益农公司 2018-11-23 CN disclosed
CN-108135185-A CONCENTRATED LOW VISCOSITY AGRICULTURAL FORMULATIONS 亨斯迈石油化学有限责任公司 2018-06-08 CN disclosed
CN-108135158-A Improved agrochemical adjuvants 艾特恩农业有限责任公司 2018-06-08 CN disclosed
CN-108137489-A Molecule and relative intermediate, composition and method with desinsection effectiveness 美国陶氏益农公司 2018-06-08 CN disclosed
CN-108135174-A Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 美国陶氏益农公司 2018-06-08 CN disclosed
CN-105007737-A 3-alkyl-5-fluoro-4-substituted-imino-3, 4-dihydropyrimidin-2 (1H) -one derivatives as fungicides DOW AGROSCIENCES LLC 2015-10-28 CN disclosed