Fumaric Acid

Fumaric Acid

SCHEMBL3189902

C=CCN(C)CCCCCCOc1ccc(C(=O)c2ccc(Br)cc2)c(F)c1.O=C(O)/C=C/C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol

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

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 1/20 0.93
KMT2A known ✓ Q03164 1/20 0.93
LSS P48449 20/20 1.00

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
Fumaric Acid SCHEMBL4437311 1.00 LSS (1.00) LSSMEN1KMT2A
Fumaric Acid SCHEMBL29455114 1.00 LSS (1.00) LSSMEN1KMT2A
SCHEMBL3674881 0.96 LSS (1.00) LSSMEN1KMT2A
Bromide SCHEMBL7685880 0.95 LSS (0.98) LSSMEN1KMT2A
Fumaric Acid SCHEMBL12477423 0.94 LSS (0.90) LSSMEN1KMT2A
SCHEMBL8760830 0.91 LSS (0.89) LSSMEN1KMT2A
Fumaric Acid SCHEMBL7681307 0.90 LSS (1.00) LSSMEN1KMT2A
Fumaric Acid SCHEMBL7681297 0.90 LSS (1.00) LSSMEN1KMT2A
Fumaric Acid SCHEMBL7685917 0.89 LSS (0.82) LSSMEN1KMT2A
Fumaric Acid SCHEMBL7685922 0.89 LSS (0.82) LSSMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10143686-B2 Oxidosqualene cyclase as a protein target for anticancer therapeutics THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2018-12-04 US claimed
US-20140005187-A1 OXIDOSQUALENE CYCLASE AS A PROTEIN TARGET FOR ANTICANCER THERAPEUTICS THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2014-01-02 US claimed
EP-2658544-A2 OXIDOSQUALENE CYCLASE AS A PROTEIN TARGET FOR ANTICANCER THERAPEUTICS The Curators Of The University Of Missouri (US) 2013-11-06 EP claimed
WO-2012092114-A2 OXIDOSQUALENE CYCLASE AS A PROTEIN TARGET FOR ANTICANCER THERAPEUTICS THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2012-07-05 WO claimed
EP-2866810-B9 INDUCTION OF ESTROGEN RECEPTOR BETA BY CHOLESTEROL BIOSYNTHESIS INHIBITORS AND METHODS OF TREATMENT OF CANCER UNIV MISSOURI (US) 2019-06-26 EP disclosed
US-10143686-B2 Oxidosqualene cyclase as a protein target for anticancer therapeutics THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2018-12-04 US disclosed
EP-2866810-B1 INDUCTION OF ESTROGEN RECEPTOR BETA BY CHOLESTEROL BIOSYNTHESIS INHIBITORS AND METHODS OF TREATMENT OF CANCER UNIV MISSOURI (US) 2018-10-03 EP disclosed
US-20150366824-A1 INDUCTION OF ESTROGEN RECEPTOR BETA BY CHOLESTEROL BIOSYNTHESIS INHIBITORS AND METHODS OF TREATMENT OF CANCER THE CURATORS OF THE UNIVERSITY OF MISSOURI 2015-12-24 US disclosed
US-20140005187-A1 OXIDOSQUALENE CYCLASE AS A PROTEIN TARGET FOR ANTICANCER THERAPEUTICS THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2014-01-02 US disclosed
EP-2658544-A2 OXIDOSQUALENE CYCLASE AS A PROTEIN TARGET FOR ANTICANCER THERAPEUTICS The Curators Of The University Of Missouri (US) 2013-11-06 EP disclosed
WO-2012092114-A2 OXIDOSQUALENE CYCLASE AS A PROTEIN TARGET FOR ANTICANCER THERAPEUTICS THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2012-07-05 WO disclosed
US-20100021893-A1 Modulators of lanosterol synthetase for treating acne or hyperseborrhea GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-01-28 US disclosed
US-20090270506-A1 CRYSTALLINE STRUCTURE OF OXIDOSQUALENE SYNTHASE RUF ARMIN 2009-10-29 US disclosed
EP-2046980-A2 MODULATORS OF LANOSTEROL SYNTHETASE IN THE TREATMENT OF ACNE OR OF HYPERSEBORRHOEA Galderma Research & Development (FR) 2009-04-15 EP disclosed
WO-2008009852-A2 MODULATORS OF LANOSTEROL SYNTHETASE IN THE TREATMENT OF ACNE OR OF HYPERSEBORRHOEA GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-01-24 WO disclosed
US-20050202548-A1 Crystalline structure of oxidosqualene synthase HOFFMANN-LA ROCHE INC. 2005-09-15 US disclosed
EP-1498482-A2 Crystal structure of oxidosqualene cyclase F. HOFFMANN-LA ROCHE AG (CH) 2005-01-19 EP 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 (3 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-20150366824-A1 INDUCTION OF ESTROGEN RECEPTOR BETA BY CHOLESTEROL BIOSYNTHESIS INHIBITORS AND METHODS OF TREATMENT OF CANCER ESRRA, ESRRB, ESRRG MEN1 4535/4885KMT2A 3444/4885LSS 276/4885
US-20140005187-A1 OXIDOSQUALENE CYCLASE AS A PROTEIN TARGET FOR ANTICANCER THERAPEUTICS HMGCR, DHCR7, CYP46A1 MEN1 2703/4885KMT2A 3327/4885LSS 128/4885
US-10143686-B2 Oxidosqualene cyclase as a protein target for anticancer therapeutics COASY, HCCS, OSBP MEN1 3695/4885KMT2A 3831/4885LSS 26/4885

“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.