Guaiacol

Guaiacol

SCHEMBL6712813

COc1ccccc1O.OCC(O)CO

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.69
TSHR P16473 2/20 0.69
CA1 P00915 2/20 0.69
CA2 P00918 2/20 0.69
LMNA P02545 4/20 0.61
CYP1A2 P05177 3/20 0.61
AGTR1 P30556 1/20 0.61
CYP3A4 P08684 3/20 0.50
KDM4E B2RXH2 3/20 0.50
MAPT P10636 2/20 0.50
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
ALOX12 P18054 1/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MMP1 P03956 1/20 0.45
CA12 O43570 1/20 0.44
CA4 P22748 1/20 0.44
CA7 P43166 1/20 0.44

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
Guaiacol SCHEMBL10429895 0.98 TSHR (0.67) TP53TSHRCA1CA2LMNA
Guaiacol SCHEMBL4245702 0.92 TSHR (0.58) TP53TSHRCA1CA2LMNA
Guaiacol SCHEMBL339020 0.90 CYP1A2 (0.63) TP53TSHRCA1CA2LMNA
Guaiacol SCHEMBL27508645 0.88 CYP1A2 (0.61) TP53TSHRCA1CA2LMNA
Guaiacol SCHEMBL27509885 0.86 CA1 (0.86) TP53TSHRCA1CA2LMNA
Guaiacol SCHEMBL10489296 0.85 TSHR (0.50) TP53TSHRCA1CA2LMNA
Guaiacol SCHEMBL27872505 0.84 TSHR (0.82) TP53TSHRCA1CA2LMNA
Guaiacol SCHEMBL21626 0.83
Guaiacol SCHEMBL29454477 0.83
Guaiacol SCHEMBL671733 0.83 CA2 (1.00) TP53TSHRCA1CA2LMNA

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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115043811-A Preparation method of 4- [ (2-methoxyphenoxy) methyl ] -1, 3-dioxolane-2-one 苏州敬业医药化工有限公司 2022-09-13 CN claimed
CN-109718276-B Compound liquorice oral solution and preparation method thereof 上海美优制药有限公司 2021-09-28 CN claimed
CN-106495995-A A kind of continuous chromatography method for splitting of guaifenesin racemic modification 华东理工大学 2017-03-15 CN claimed
CN-115043811-A Preparation method of 4- [ (2-methoxyphenoxy) methyl ] -1, 3-dioxolane-2-one 苏州敬业医药化工有限公司 2022-09-13 CN disclosed
CN-109718276-B Compound liquorice oral solution and preparation method thereof 上海美优制药有限公司 2021-09-28 CN disclosed
CN-109922803-A Use of lysyl oxidase-like 2 inhibitors 法玛克亚公司 2019-06-21 CN disclosed
CN-109476641-A Heterocyclic inhibitors of CBP/EP300 and their use in the treatment of cancer 基因泰克公司 2019-03-15 CN disclosed
CN-109476663-A PYRAZOLOPYRIDINE DERIVATIVES FOR THE TREATMENT OF CANCER 基因泰克公司 2019-03-15 CN disclosed
CN-105377249-B Neo-synephrine resinate particle and its use in pharmaceutical formulation 强生消费者公司 2019-03-08 CN disclosed
CN-105640956-B Compound codeine phosphate combined oral liquid without preservative and preparation method thereof 澳美制药厂有限公司 2018-09-14 CN disclosed
CN-207254326-U A kind of device for being used in pharmacy procedure control local air humidity 上海合全医药有限公司 2018-04-20 CN disclosed
CN-102149825-A Prostaglandin E2 dual variable domain immunoglobulins and uses thereof ABBOTT LAB 2011-08-10 CN disclosed
CN-102112494-A Dual variable domain immunoglobulins and uses thereof ABBOTT LAB 2011-06-29 CN disclosed
CN-102112495-A Dual variable domain immunoglobulins and uses thereof ABBOTT LAB 2011-06-29 CN disclosed
CN-102076355-A Dual varistructure domain immunoglobulins and uses thereof ABBOTT LAB 2011-05-25 CN disclosed
CN-101525278-A New synthetic method of guaiacol glycerin ether UNIV ZHEJIANG TECHNOLOGY 2009-09-09 CN disclosed
CN-101291582-A Novel imidazo based heterocycles ABBOTT LAB (US) 2008-10-22 CN disclosed
CN-1592606-A Method for granulation of active substances by low pressure extrusion to obtain directly compressible granules RHONE POULENC CHIMIE (FR) 2005-03-09 CN disclosed
US-20040013735-A1 Method for granulation of active substances by low pressure extrusion to obtain directly compressible granules RHODIA CHIMIE (FR) 2004-01-22 US disclosed
CN-1130863-A Compositions containing phosphate ester or salt derivatives PROCTER & GAMBLE (US) 1996-09-11 CN disclosed