SCHEMBL3044602

SCHEMBL3044602

[Li]Cc1c(C)c(OC)c(C)c(C)c1OC

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 4/20 0.31
IMPDH1 P20839 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30

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
SCHEMBL15071874 0.79 CA2 (0.42) IMPDH2IMPDH1CA1CA2CA4
SCHEMBL2029504 0.75 IMPDH2 (0.33) IMPDH2IMPDH1CA1CA2CA4
SCHEMBL9549629 0.75 CA2 (0.46) IMPDH2IMPDH1CA2CA4
SCHEMBL7508538 0.75 CA2 (0.34) IMPDH2IMPDH1CA1CA2CA4
SCHEMBL2952712 0.74 ACHE (0.40) CA1CA2CA4CA6
SCHEMBL1820953 0.71 IMPDH2 (0.32) IMPDH2IMPDH1
SCHEMBL8563125 0.71 IMPDH2 (0.49) IMPDH2IMPDH1CA2CA4
SCHEMBL1783169 0.71 HTR2A (0.46) IMPDH2IMPDH1
SCHEMBL10405923 0.71 IMPDH2 (0.33) IMPDH2IMPDH1CA1CA2CA4
SCHEMBL85826 0.71 ACHE (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220055975-A1 REDOX-ACTIVE THERAPEUTICS FOR TREATMENT OF MITOCHONDRIAL DISEASES AND OTHER CONDITIONS AND MODULATION OF ENERGY BIOMARKERS PTC THERAPEUTICS, INC. 2022-02-24 US disclosed
US-11021424-B2 Redox-active therapeutics for treatment of mitochondrial diseases and other conditions and modulation of energy biomarkers PTC THERAPEUTICS, INC. (US) 2021-06-01 US disclosed
EP-2564843-B1 Redox-active therapeutics for treatment of mitochondrial diseases and other conditions and modulation of energy biomarkers BIOELECTRON TECH CORP (US) 2018-12-26 EP disclosed
EP-2471530-B1 REDOX-ACTIVE THERAPEUTICS FOR TREATMENT OF MITOCHONDRIAL DISEASES AND OTHER CONDITIONS AND MODULATION OF ENERGY BIOMARKERS EDISON PHARMACEUTICALS INC (US) 2017-01-11 EP disclosed
US-9447006-B2 Redox-active therapeutics for treatment of mitochondrial diseases and other conditions and modulation of energy biomarkers EDISON PHARMACEUTICALS, INC. (US) 2016-09-20 US disclosed
EP-1888059-B1 REDOX-ACTIVE THERAPEUTICS FOR TREATMENT OF MITOCHONDRIAL DISEASES AND OTHER CONDITIONS AND MODULATION OF ENERGY BIOMARKERS EDISON PHARMACEUTICALS INC (US) 2014-12-17 EP disclosed
EP-2564842-A1 Redox-active therapeutics for treatment of mitochondrial diseases and other conditions and modulation of energy biomarkers Edison Pharmaceuticals, Inc. (US) 2013-03-06 EP disclosed
EP-2564843-A1 Redox-active therapeutics for treatment of mitochondrial diseases and other conditions and modulation of energy biomarkers Edison Pharmaceuticals, Inc. (US) 2013-03-06 EP disclosed
EP-2471530-A1 Redox-active Therapeutics For Treatment Of Mitochondrial Diseases And Other Conditions And Modulation Of Energy Biomarkers Edison Pharmaceuticals, Inc. (US) 2012-07-04 EP disclosed
US-20100222436-A1 REDOX-ACTIVE THERAPEUTICS FOR TREATMENT OF MITOCHONDRIAL DISEASES AND OTHER CONDITIONS AND MODULATION OF ENERGY BIOMARKERS PTC THERAPEUTICS, INC. 2010-09-02 US disclosed
EP-1888059-A2 REDOX-ACTIVE THERAPEUTICS FOR TREATMENT OF MITOCHONDRIAL DISEASES AND OTHER CONDITIONS AND MODULATION OF ENERGY BIOMAKERS Edison Pharmaceuticals, Inc. (US) 2008-02-20 EP disclosed
US-20060281809-A1 Redox-active therapeutics for treatment of mitochondrial diseases and other conditions and modulation of energy biomarkers PTC THERAPEUTICS, INC. 2006-12-14 US disclosed
WO-2006130775-A2 REDOX-ACTIVE THERAPEUTICS FOR TREATMENT OF MITOCHONDRIAL DISEASES AND OTHER CONDITIONS AND MODULATION OF ENERGY BIOMAKERS EDISON PHARMACEUTICALS, INC. (US) 2006-12-07 WO disclosed
EP-0257503-B1 PROCESS FOR THE PRODUCTION OF OPTICALLY ACTIVE HYDROQUINONE DERIVATIVES AND D-ALPHA-TOCOPHEROL F. HOFFMANN-LA ROCHE AG (CH) 1990-05-23 EP disclosed
US-4808736-A Process for the preparation of hydroquinone derivatives and d-α-tocopherol HOFFMANN-LAROCHE INC. (US) 1989-02-28 US disclosed
EP-0257503-A1 Process for the production of optically active hydroquinone derivatives and d-alpha-tocopherol F. HOFFMANN-LA ROCHE AG (CH) 1988-03-02 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 (4 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-20060281809-A1 Redox-active therapeutics for treatment of mitochondrial diseases and other conditions and modulation of energy biomarkers ECHS1, FH, ACAA2 IMPDH2 3688/4885IMPDH1 3441/4885CA1 2709/4885
US-20100222436-A1 REDOX-ACTIVE THERAPEUTICS FOR TREATMENT OF MITOCHONDRIAL DISEASES AND OTHER CONDITIONS AND MODULATION OF ENERGY BIOMARKERS ECHS1, FH, ACAA2 IMPDH2 3688/4885IMPDH1 3441/4885CA1 2709/4885
US-11021424-B2 Redox-active therapeutics for treatment of mitochondrial diseases and other conditions and modulation of energy biomarkers ECHS1, FH, ACAA2 IMPDH2 3688/4885IMPDH1 3441/4885CA1 2709/4885
US-20220055975-A1 REDOX-ACTIVE THERAPEUTICS FOR TREATMENT OF MITOCHONDRIAL DISEASES AND OTHER CONDITIONS AND MODULATION OF ENERGY BIOMARKERS ECHS1, FH, ACAA2 IMPDH2 3688/4885IMPDH1 3441/4885CA1 2709/4885

“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.