Nectandrin B

Nectandrin B

SCHEMBL893163

COc1cc([C@H]2O[C@@H](c3ccc(O)c(OC)c3)[C@@H](C)[C@@H]2C)ccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 2/20 1.00
PTAFR P25105 1/20 0.72
CA2 P00918 2/20 0.67
ALOX5 P09917 1/20 0.64
PTPN1 P18031 1/20 0.64
PPARG P37231 1/20 0.64
PPARD Q03181 1/20 0.64
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
CYP3A4 P08684 1/20 0.57
HIF1A Q16665 1/20 0.54
EPAS1 Q99814 1/20 0.54

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
Nectandrin B SCHEMBL29351645 1.00 NR3C1 (1.00) NR3C1PTAFRCA2ALOX5PTPN1
Tetrahydrofuroguaiacin B SCHEMBL29484565 1.00 NR3C1 (1.00) NR3C1PTAFRCA2ALOX5PTPN1
Nectandrin B SCHEMBL30678749 1.00 NR3C1 (1.00) NR3C1PTAFRCA2ALOX5PTPN1
Nectandrin B SCHEMBL13506165 1.00 NR3C1 (1.00) NR3C1PTAFRCA2ALOX5PTPN1
Nectandrin B SCHEMBL12118675 1.00 NR3C1 (1.00) NR3C1PTAFRCA2ALOX5PTPN1
Nectandrin B SCHEMBL893437 1.00 NR3C1 (1.00) NR3C1PTAFRCA2ALOX5PTPN1
Tetrahydrofuroguaiacin B SCHEMBL12118597 1.00 NR3C1 (1.00) NR3C1PTAFRCA2ALOX5PTPN1
Nectandrin B SCHEMBL17145939 1.00 NR3C1 (1.00) NR3C1PTAFRCA2ALOX5PTPN1
Nectandrin A SCHEMBL13506024 0.95 NR3C1 (0.91) NR3C1PTAFRCA2ALOX5PTPN1
Nectandrin A SCHEMBL893331 0.95 NR3C1 (0.91) NR3C1PTAFRCA2ALOX5PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110291401-B Fibroblast Activation Protein (FAP) -targeted imaging and therapy 普渡研究基金会 2023-04-11 CN claimed
EP-2438923-B1 COMPOSITION FOR PREVENTING OR TREATING OBESITY-RELATED DISEASES MEDIATED BY THE ACTIVATION OF AMPK AND INCLUDING 2,5-BIS-ARYL-3,4-DIMETHYLTETRAHYDROFURAN LIGNANS AS ACTIVE INGREDIENTS UNIV CHOSUN IACF (KR) 2015-03-18 EP claimed
CN-103936698-A Composition For Preventing Or Treating Adiposity Or Metabolism Syndrome UNIV CHOSUN IACF (KR) 2014-07-23 CN claimed
CN-102481325-B Composition for preventing or treating obesity-related diseases mediated by activation of AMPK, containing 2, 5-diaryl-3, 4-dimethyltetrahydrofurfuryl lignan as an active ingredient UNIV CHOSUN IACF (KR) 2014-05-28 CN claimed
US-20120083525-A1 COMPOSITION FOR PREVENTING OR TREATING OBESITY-RELATED DISEASES MEDIATED BY THE ACTIVATION OF AMPK AND INCLUDING 2,5-BIS-ARYL-3,4-DIMETHYLTETRAHYDROFURAN LIGNANS AS ACTIVE INGREDIENTS AMOREPACIFIC CORPORATION 2012-04-05 US claimed
CN-115197921-B Schisandra chinensis pinoresinol-lariciresinol reductase and encoding gene and application thereof 上海中医药大学 2023-09-22 CN disclosed
CN-115197921-A Schisandra chinensis pinoresinol-lariciresinol reductase and encoding gene and application thereof 上海中医药大学 2022-10-18 CN disclosed
EP-3747452-A1 COMPOSITION FOR IMPROVING PHYSICAL STRENGTH OR ATHLETIC ABILITY, CONTAINING NUTMEG EXTRACT AS ACTIVE INGREDIENT Korea Basic Science Institute (KR) 2020-12-09 EP disclosed
CN-112040964-A A composition containing Myristica fragrans Houtt extract as active ingredient for improving physical strength or athletic ability 韩国基础科学研究院 2020-12-04 CN disclosed
US-20200360455-A1 COMPOSITION FOR IMPROVING PHYSICAL STRENGTH OR ATHLETIC ABILITY, CONTAINING NUTMEG EXTRACT AS ACTIVE INGREDIENT KOREA BASIC SCIENCE INSTITUTE (KP) 2020-11-19 US disclosed
WO-2019151811-A1 COMPOSITION FOR IMPROVING PHYSICAL STRENGTH OR ATHLETIC ABILITY, CONTAINING NUTMEG EXTRACT AS ACTIVE INGREDIENT 한국기초과학지원연구원 2019-08-08 WO disclosed
EP-2438923-B1 COMPOSITION FOR PREVENTING OR TREATING OBESITY-RELATED DISEASES MEDIATED BY THE ACTIVATION OF AMPK AND INCLUDING 2,5-BIS-ARYL-3,4-DIMETHYLTETRAHYDROFURAN LIGNANS AS ACTIVE INGREDIENTS UNIV CHOSUN IACF (KR) 2015-03-18 EP disclosed
CN-103936698-A Composition For Preventing Or Treating Adiposity Or Metabolism Syndrome UNIV CHOSUN IACF (KR) 2014-07-23 CN disclosed
CN-102481325-B Composition for preventing or treating obesity-related diseases mediated by activation of AMPK, containing 2, 5-diaryl-3, 4-dimethyltetrahydrofurfuryl lignan as an active ingredient UNIV CHOSUN IACF (KR) 2014-05-28 CN disclosed
CN-102327368-B Chinese lizardtail rhizome or herb rootstock total effective fraction and preparation method and application thereof CHENGDU DIAO PHARMACY GROUP CO LTD 2013-07-24 CN disclosed
CN-102481325-A Composition for preventing or treating obesity-related diseases mediated by activation of AMPK, containing 2, 5-diaryl-3, 4-dimethyltetrahydrofurfuryl lignan as an active ingredient UNIV CHOSUN IACF 2012-05-30 CN disclosed
US-20120083525-A1 COMPOSITION FOR PREVENTING OR TREATING OBESITY-RELATED DISEASES MEDIATED BY THE ACTIVATION OF AMPK AND INCLUDING 2,5-BIS-ARYL-3,4-DIMETHYLTETRAHYDROFURAN LIGNANS AS ACTIVE INGREDIENTS AMOREPACIFIC CORPORATION 2012-04-05 US disclosed
CN-102327368-A Chinese lizardtail rhizome or herb rootstock total effective fraction and preparation method and application thereof CHENGDU DIAO PHARMACEUTICAL GROUP CO LTD 2012-01-25 CN disclosed
WO-2010140734-A1 COMPOSITION FOR PREVENTING OR TREATING OBESITY-RELATED DISEASES MEDIATED BY THE ACTIVATION OF AMPK AND INCLUDING 2,5-BIS-ARYL-3,4-DIMETHYLTETRAHYDROFURAN LIGNANS AS ACTIVE INGREDIENTS 조선대학교산학협력단 (KR) 2010-12-09 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 (1 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-20120083525-A1 COMPOSITION FOR PREVENTING OR TREATING OBESITY-RELATED DISEASES MEDIATED BY THE ACTIVATION OF AMPK AND INCLUDING 2,5-BIS-ARYL-3,4-DIMETHYLTETRAHYDROFURAN LIGNANS AS ACTIVE INGREDIENTS PRKAG1, PRKAG3, PRKAG2 NR3C1 3543/4885PTAFR 1160/4885CA2 3553/4885

“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.