Catechol

Catechol

SCHEMBL28294850

NCCNCCNCCNCCN.Oc1ccccc1O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 9/20 0.52
CA2 P00918 8/20 0.52
CA9 Q16790 7/20 0.52
CA14 Q9ULX7 4/20 0.52
CA5B Q9Y2D0 4/20 0.52
LMNA P02545 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
CA3 P07451 3/20 0.52
CA4 P22748 3/20 0.52
CA6 P23280 3/20 0.52
CA5A P35218 3/20 0.52
CA7 P43166 3/20 0.52
ALOX15 P16050 2/20 0.52
ALDH1A1 P00352 2/20 0.52
CA1 P00915 1/20 0.52
TP53 P04637 1/20 0.52
KDM4E B2RXH2 3/20 0.50
RECQL P46063 2/20 0.48
HSD17B10 Q99714 2/20 0.48
HIF1A Q16665 2/20 0.48

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
Trientine SCHEMBL29145954 1.00 CA12 (0.52) CA12CA2CA9CA14CA5B
Trientine SCHEMBL8562243 0.88 CA12 (0.41) CA12CA2CA9CA14CA5B
Catechol SCHEMBL8562155 0.86 CA12 (0.40) CA12CA2CA9CA14CA5B
Trientine SCHEMBL29145929 0.86 CA12 (0.42) CA12CA2CA9CA14CA5B
Orthocresol SCHEMBL29145949 0.86 CA12 (0.42) CA12CA2CA9CA14CA5B
Orthocresol SCHEMBL29145945 0.86 CA12 (0.42) CA12CA2CA9CA14CA5B
Trientine SCHEMBL29145944 0.86 ALDH1A1 (0.58) CA12CA2CA9CA14CA5B
SCHEMBL7914586 0.84 CA12 (0.78) CA12CA2CA9KDM4EHSD17B10
SCHEMBL12996038 0.84 CA12 (0.78) CA12CA2CA9KDM4EHSD17B10
Trientine SCHEMBL29145939 0.84 CA12 (0.50) CA12CA2CA9CA14CA5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117004223-A Method for improving mechanical properties of conductive rubber by using phenolic amine to modify silver-plated powder 太原工业学院 2023-11-07 CN disclosed
CN-115353620-B Polyphenol nanoparticle and preparation method and application thereof 中海石油(中国)有限公司 2023-10-31 CN disclosed
CN-116927691-A Preparation method of core-taking sponge lining cylinder and hydrophobic oil-absorbing sponge 中石化石油工程技术服务有限公司 2023-10-24 CN disclosed
CN-115353620-A Polyphenol nano particle and preparation method and application thereof 中海石油(中国)有限公司 2022-11-18 CN disclosed
CN-110552193-B Modified ultrahigh molecular weight polyethylene fiber, fabric and preparation method and application thereof 中国科学院化学研究所 2021-05-18 CN disclosed
CN-111944144-A Self-supporting catecholamine film and preparation method and application thereof 齐鲁工业大学 2020-11-17 CN disclosed
CN-110552193-A modified ultrahigh molecular weight polyethylene fiber, fabric and preparation method and application thereof INST CHEMISTRY CAS 2019-12-10 CN disclosed
CN-106436306-B A kind of surface modifying method of fiber 北京化工大学 2019-05-17 CN disclosed
CN-106011809-B A method of preparing the composite material of coated with silver on surface by catechol-polyamines 北京化工大学 2018-10-23 CN disclosed