SCHEMBL311067

SCHEMBL311067

O=C(O)CCc1c2ccccc2c(CCC(=O)O)c2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.60
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
EGFR P00533 3/20 0.56
SRC P12931 1/20 0.56
FFAR1 O14842 5/20 0.56
HDAC3 O15379 1/20 0.50
MAPK1 P28482 1/20 0.50
ADRA1A P35348 1/20 0.50
HDAC4 P56524 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HDAC1 Q13547 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC9 Q9UKV0 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
SCHEMBL29564062 1.00 KEAP1 (0.60) KEAP1KDM4EALDH1A1EGFRSRC
SCHEMBL7605310 0.98 KEAP1 (0.58) KEAP1KDM4EALDH1A1EGFRSRC
SCHEMBL7605316 0.98 KEAP1 (0.58) KEAP1KDM4EALDH1A1EGFRSRC
Phenyl Propionic Acid SCHEMBL7826574 0.92 KEAP1 (0.76) KEAP1KDM4EALDH1A1FFAR1HDAC3
SCHEMBL9782880 0.90 FFAR1 (0.68) KEAP1KDM4EALDH1A1EGFRSRC
SCHEMBL11987690 0.90 EGFR (0.50) KEAP1KDM4EALDH1A1EGFRSRC
SCHEMBL9426100 0.90 ALDH1A1 (0.50) KEAP1KDM4EALDH1A1EGFRSRC
SCHEMBL9782874 0.88 KEAP1 (0.59) KEAP1KDM4EALDH1A1EGFRSRC
SCHEMBL9782888 0.87 RXFP1 (0.53) KEAP1KDM4EALDH1A1EGFRSRC
SCHEMBL28613421 0.86 HDAC3 (0.63) KEAP1KDM4EALDH1A1EGFRFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116514633-A Synthesis method of 3,3' - (anthracene-9, 10-diyl) dipropionic acid 上海麦克林生化科技股份有限公司 2023-08-01 CN claimed
CN-108530243-B Process for the manufacture of nitriles and their corresponding amines 中国石化扬子石油化工有限公司 2022-05-27 CN claimed
CN-108546224-B Process for the manufacture of nitriles and their corresponding amines 中国石化扬子石油化工有限公司 2022-05-27 CN claimed
CN-108530244-B Process for the manufacture of nitriles and their corresponding amines 中国石化扬子石油化工有限公司 2022-02-11 CN claimed
CN-105016941-A Process for the manufacture of nitriles and their corresponding amines SINOPEC YANGZI PETROCHEMICAL 2015-11-04 CN claimed
CN-105016945-A Process for the manufacture of nitriles and their corresponding amines SINOPEC YANGZI PETROCHEMICAL 2015-11-04 CN claimed
CN-105001033-A Process for the manufacture of nitriles and their corresponding amines SINOPEC YANGZI PETROCHEMICAL 2015-10-28 CN claimed
CN-1875030-A Ozonation products of cholesterol for the treatment and prevention of atherosclerosis and/or cardiovascular disease SCRIPPS RES INSITTUTE (US) 2006-12-06 CN claimed
US-20060217359-A1 Therapeutic procedures NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2006-09-28 US claimed
EP-1670812-A2 OZONATION PRODUCTS OF CHOLESTEROL FOR THE TREATMENT AND PREVENTION OF ATHEROSCLEROSIS AND/OR CARDIOVASCULAR DISEASES The Scripps Research Institute (US) 2006-06-21 EP claimed
US-20050085557-A1 Oxidation of cholesterol in atherosclerosis plaque; cytotoxic SCRIPPS RESEARCH INSTITUTE, THE 2005-04-21 US claimed
WO-2005023830-A2 OZONATION PRODUCTS OF CHOLESTEROL FOR THE TREATMENT AND PREVENTION OF ATHEROSCLEROSIS AND/OR CARDIOVASCULAR DISEASES THE SCRIPPS RESEARCH INSTITUTE (US) 2005-03-17 WO claimed
JP-7076511-A None JP disclosed
JP-7069855-A None JP disclosed
JP-7069856-A None JP disclosed
US-12433870-B2 Supramolecular photoprotection of a photosensitizer NORTHWESTERN UNIVERSITY (US) 2025-10-07 US disclosed
JP-H0776511-A COSMETIC TOYOBO CO LTD 1995-03-20 JP disclosed
JP-H0769855-A COSMETIC TOYOBO CO LTD 1995-03-14 JP disclosed
JP-H0769856-A COSMETIC TOYOBO CO LTD 1995-03-14 JP disclosed
EP-0515194-A2 Assay methods utilizing induced luminescence BEHRINGWERKE Aktiengesellschaft (DE) 1992-11-25 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-12433870-B2 Supramolecular photoprotection of a photosensitizer PCNA, HAVCR2, CD47 KEAP1 1318/4885KDM4E 4837/4885ALDH1A1 2875/4885
US-20050085557-A1 Oxidation of cholesterol in atherosclerosis plaque; cytotoxic APOB, LDLR, CETP KEAP1 452/4885KDM4E 4771/4885ALDH1A1 2866/4885
US-20060217359-A1 Therapeutic procedures APOB, LIPA, CETP KEAP1 563/4885KDM4E 4794/4885ALDH1A1 2247/4885

“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.