Bardoxolone Methyl

Bardoxolone Methyl

SCHEMBL702067

COC(=O)[C@]12CCC(C)(C)C[C@@H]1[C@H]1C(=O)C=C3[C@@]4(C)C=C(C#N)C(=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

IKBKBKEAP1NFE2L2PPARG

The experimentally established mechanism targets of Bardoxolone Methyl. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NFE2L2 known ✓ Q16236 3/20 1.00
KEAP1 known ✓ Q14145 2/20 0.83
MBOAT4 Q96T53 4/20 1.00
USP7 Q93009 2/20 1.00
USP2 O75604 1/20 1.00
STAT3 P40763 1/20 1.00
RORC P51449 1/20 0.86
NOS2 P35228 9/20 0.83
CYP3A4 P08684 2/20 0.83
CYP2C19 P33261 2/20 0.83
CYP2C9 P11712 1/20 0.83
CCR6 P51684 1/20 0.71

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
Bardoxolone Methyl SCHEMBL18910897 1.00 MBOAT4 (1.00) MBOAT4NFE2L2USP7USP2STAT3
Bardoxolone Methyl SCHEMBL15184347 1.00 MBOAT4 (1.00) MBOAT4NFE2L2USP7USP2STAT3
Bardoxolone Methyl SCHEMBL19635256 1.00 MBOAT4 (1.00) MBOAT4NFE2L2USP7USP2STAT3
Bardoxolone Methyl SCHEMBL91615 1.00 MBOAT4 (1.00) MBOAT4NFE2L2USP7USP2STAT3
Bardoxolone Methyl SCHEMBL12521530 1.00 MBOAT4 (1.00) MBOAT4NFE2L2USP7USP2STAT3
Bardoxolone Methyl SCHEMBL18572802 1.00 MBOAT4 (1.00) MBOAT4NFE2L2USP7USP2STAT3
Bardoxolone Methyl SCHEMBL23896957 1.00 MBOAT4 (1.00) MBOAT4NFE2L2USP7USP2STAT3
Bardoxolone Methyl SCHEMBL21577829 1.00 MBOAT4 (1.00) MBOAT4NFE2L2USP7USP2STAT3
Bardoxolone Methyl SCHEMBL22213797 1.00 MBOAT4 (1.00) MBOAT4NFE2L2USP7USP2STAT3
Bardoxolone Methyl SCHEMBL25906069 1.00 MBOAT4 (1.00) MBOAT4NFE2L2USP7USP2STAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024047248-A1 USE OF NRF2 ACTIVATORS FOR THE TREATMENT OF CEREBRAL SMALL VESSEL DISEASE Institut National de la Santé et de la Recherche Médicale (FR) 2024-03-07 WO claimed
US-20210069159-A1 Bach1 Inhibitors in Combination with Nrf2 Activators and Pharmaceutical Compositions Thereof VTV THERAPEUTICS LLC 2021-03-11 US claimed
US-10898475-B2 Bach1 inhibitors in combination with Nrf2 activators and pharmaceutical compositions thereof VTV THERAPEUTICS LLC (US) 2021-01-26 US claimed
US-10760129-B2 Th17 differentiation markers for acne and uses thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2020-09-01 US claimed
US-10463652-B2 Bach1 inhibitors in combination with Nrf2 activators and pharmaceutical compositions thereof VTV THERAPEUTICS LLC (US) 2019-11-05 US claimed
US-20190076410-A1 Bach1 Inhibitors in Combination with Nrf2 Activators and Pharmaceutical Compositions Thereof VTV THERAPEUTICS LLC 2019-03-14 US claimed
US-10172840-B2 Bach1 inhibitors in combination with Nrf2 activators and pharmaceutical compositions thereof VTV THERAPEUTICS LLC (US) 2019-01-08 US claimed
US-20170231967-A1 Bach1 Inhibitors in Combination with Nrf2 Activators and Pharmaceutical Compositions Thereof VTV THERAPEUTICS LLC 2017-08-17 US claimed
US-20170056373-A1 GHRELIN O-ACYLTRANSFERASE INHIBITORS SYRACUSE UNIVERSITY (US) 2017-03-02 US claimed
US-20160326590-A1 TH17 DIFFERENTIATION MARKERS FOR ACNE AND USES THEREOF GALDERMA RESEARCH & DEVELOPMENT (FR) 2016-11-10 US claimed
WO-2016089648-A1 BACH 1 INHIBITORS IN COMBINATION WITH NRF2 ACTIVATORS AND PHARMACEUTICAL COMPOSITIONS THEREOF VTV THERAPEUTICS LLC (US) 2016-06-09 WO claimed
US-8981144-B2 Method for synthesizing 2-cyano-3,12-dioxoolean-1, 9(11)-dien-28-oic acid methyl ester and derivatives thereof TRUSTEES OF DARTMOUTH COLLEGE (US) 2015-03-17 US claimed
EP-2793876-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING GLITAZONES AND NRF2 ACTIVATORS Ares Trading S.A. (CH) 2014-10-29 EP claimed
US-20140235475-A1 TH17 DIFFERENTIATION MARKERS FOR ACNE AND USES THEREOF GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-08-21 US claimed
US-20140221648-A1 TH17 DIFFERENTIATION MARKERS FOR ACNE AND USES THEREOF GALDERMA RESEARCH & DEVELOPEMENT (FR) 2014-08-07 US claimed
US-20140221231-A1 TH-17 DIFFERENTIATION MARKERS FOR ROSACEA AND USES THEREOF GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-08-07 US claimed
EP-2723890-A1 NEW TH17 DIFFERENTIATION MARKERS FOR ACNE AND USES THEREOF Galderma Research & Development (FR) 2014-04-30 EP claimed
US-20130303797-A1 METHOD FOR SYNTHESIZING 2-CYANO-3,12-DIOXOOLEAN-1, 9(11)-DIEN-28-OIC ACID METHYL ESTER AND DERIVATIVES THEREOF TRUSTEES OF DARTMOUTH COLLEGE (US) 2013-11-14 US claimed
WO-2013092269-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING GLITAZONES AND NRF2 ACTIVATORS ARES TRADING S.A. (CH) 2013-06-27 WO claimed
WO-2013000870-A1 NEW TH17 DIFFERENTIATION MARKERS FOR ACNE AND USES THEREOF GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-01-03 WO claimed

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

For each of this compound's patents that has machine-readable text (7 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-20130303797-A1 METHOD FOR SYNTHESIZING 2-CYANO-3,12-DIOXOOLEAN-1, 9(11)-DIEN-28-OIC ACID METHYL ESTER AND DERIVATIVES THEREOF HAAO, CYP8B1, OXER1 NFE2L2 3039/4885KEAP1 1464/4885MBOAT4 303/4885
US-10463652-B2 Bach1 inhibitors in combination with Nrf2 activators and pharmaceutical compositions thereof BACH1, KEAP1, NFE2L2 NFE2L2 3/4885KEAP1 2/4885MBOAT4 3721/4885
US-20190076410-A1 Bach1 Inhibitors in Combination with Nrf2 Activators and Pharmaceutical Compositions Thereof BACH1, KEAP1, NFE2L2 NFE2L2 3/4885KEAP1 2/4885MBOAT4 3721/4885
US-20170231967-A1 Bach1 Inhibitors in Combination with Nrf2 Activators and Pharmaceutical Compositions Thereof BACH1, KEAP1, NFE2L2 NFE2L2 3/4885KEAP1 2/4885MBOAT4 3721/4885
US-10898475-B2 Bach1 inhibitors in combination with Nrf2 activators and pharmaceutical compositions thereof BACH1, KEAP1, NFE2L2 NFE2L2 3/4885KEAP1 2/4885MBOAT4 2888/4885
US-20210069159-A1 Bach1 Inhibitors in Combination with Nrf2 Activators and Pharmaceutical Compositions Thereof BACH1, KEAP1, NFE2L2 NFE2L2 3/4885KEAP1 2/4885MBOAT4 3656/4885
US-10172840-B2 Bach1 inhibitors in combination with Nrf2 activators and pharmaceutical compositions thereof BACH1, KEAP1, NFE2L2 NFE2L2 3/4885KEAP1 2/4885MBOAT4 3721/4885

“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.