1,3-Dimethoxybenzene

1,3-Dimethoxybenzene

SCHEMBL4624082

COc1cccc(OC)c1.OB(O)O

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.68
ACHE P22303 1/20 0.58
ALDH1A1 P00352 2/20 0.56
CYP3A4 P08684 2/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 0.56
CES2 O00748 1/20 0.56
CES1 P23141 1/20 0.56
LMNA P02545 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
PARP1 P09874 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
PRSS1 P07477 1/20 0.52
PRSS2 P07478 1/20 0.52
PRSS3 P35030 1/20 0.52
CYP1A1 P04798 1/20 0.50
CYP1A2 P05177 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
1,3-Dimethoxybenzene SCHEMBL27700724 0.89 ACHE (0.64) ENPP2ACHEALDH1A1CYP3A4CA1
1,3-Dimethoxybenzene SCHEMBL9350 0.89 ACHE (0.70) ENPP2ACHEALDH1A1CYP3A4CA1
1,3-Dimethoxybenzene SCHEMBL901285 0.89 ACHE (0.70) ENPP2ACHEALDH1A1CYP3A4CA1
SCHEMBL1676924 0.86 ENPP2 (0.59) ENPP2ACHEALDH1A1CYP3A4CA1
1,3-Dimethoxybenzene SCHEMBL7860661 0.86 ACHE (0.67) ENPP2ACHEALDH1A1CYP3A4CA1
1,3-Dimethoxybenzene SCHEMBL15870025 0.86 ACHE (0.67) ENPP2ACHEALDH1A1CYP3A4CA1
1,3-Dimethoxybenzene SCHEMBL28343465 0.86 ACHE (0.67) ENPP2ACHEALDH1A1CYP3A4CA1
1,3-Dimethoxybenzene SCHEMBL28542304 0.86 ACHE (0.67) ENPP2ACHEALDH1A1CYP3A4CA1
1,3-Dimethoxybenzene SCHEMBL28135915 0.86 ACHE (0.67) ENPP2ACHEALDH1A1CYP3A4CA1
1,3-Dimethoxybenzene SCHEMBL28262290 0.86 ACHE (0.67) ENPP2ACHEALDH1A1CYP3A4CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0971878-B1 AMINE COMPOUNDS, THEIR PRODUCTION AND USE AS AMYLOID-BETA PRODUCTION INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2008-03-26 EP disclosed
US-7256204-B2 Amine compounds, their production and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-08-14 US disclosed
US-20040077867-A1 Amine compounds, their production and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-22 US disclosed
US-6613805-B2 For therapy and prophylaxis of neurodegenerative diseases such as Alzheimer's disease, Down's syndrome, Parkinson's disease, Creutzfeldt-Jacob disease, amyotrophic sclerosis on lateral fasciculus, multiple sclerosis, and neurological disorders TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-09-02 US disclosed
US-20020032189-A1 For therapy and prophylaxis of neurodegenerative diseases such as Alzheimer's disease, Down's syndrome, Parkinson's disease, Creutzfeldt-Jacob disease, amyotrophic sclerosis on lateral fasciculus, multiple sclerosis, and neurological disorders THE UNIVERSITY OF TOKYO (JP) 2002-03-14 US disclosed
US-6310107-B1 (+)-6-(4-BIPHENYLYL)METHOXY-2-(2-(N,N-DIMETHYLAMINO)ETHYL)TETR ALIN, OR A SALT IS USEFUL FOR INHIBITING PRODUCTION AND/OR SECRETION OF AMYLOID-BETA PROTEIN TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-10-30 US disclosed
EP-0971878-A1 AMINE COMPOUNDS, THEIR PRODUCTION AND USE AS AMYLOID-BETA PRODUCTION INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2000-01-19 EP disclosed
WO-1998038156-A1 AMINE COMPOUNDS, THEIR PRODUCTION AND USE AS AMYLOID-BETA PRODUCTION INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020032189-A1 For therapy and prophylaxis of neurodegenerative diseases such as Alzheimer's disease, Down's syndrome, Parkinson's disease, Creutzfeldt-Jacob disease, amyotrophic sclerosis on lateral fasciculus, multiple sclerosis, and neurological disorders PARK7, PSEN1, PRNP ENPP2 317/4885ACHE 1381/4885ALDH1A1 4024/4885
US-20040077867-A1 Amine compounds, their production and use QSOX1, APP, NPR1 ENPP2 250/4885ACHE 568/4885ALDH1A1 1955/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.