⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2780501 | 1.00 | — | — | |
| SCHEMBL427301 | 1.00 | — | — | |
| Hydrogen Peroxide SCHEMBL29015874 | 0.95 | NFE2L2 (0.60) | — | |
| Dimethyl Maleate SCHEMBL75864 | 0.81 | NFE2L2 (1.00) | — | |
| Dimethyl Fumarate SCHEMBL11668350 | 0.81 | NFE2L2 (1.00) | — | |
| Dimethyl Fumarate SCHEMBL41836 | 0.81 | NFE2L2 (1.00) | — | |
| Dimethyl Fumarate SCHEMBL41835 | 0.81 | NFE2L2 (1.00) | — | |
| Dimethyl Maleate SCHEMBL7057629 | 0.78 | NFE2L2 (0.93) | — | |
| Dimethyl Maleate SCHEMBL6505431 | 0.78 | NFE2L2 (0.93) | — | |
| Dimethyl Fumarate SCHEMBL21219085 | 0.78 | NFE2L2 (0.93) | — |
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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-122010831-A | Preparation method of 4-trifluoromethyl nicotinic acid | 衢州凯沃化工有限公司 | 2026-05-12 | — | — | CN | claimed |
| CN-114349694-B | Synthetic method of 4-trifluoromethyl nicotinic acid | 淮北龙溪生物科技有限公司 | 2022-11-08 | — | — | CN | claimed |
| EP-0326389-B1 | Process for preparing 4-hydroxypyrimidine | UBE INDUSTRIES (JP) | 1996-09-11 | — | — | EP | claimed |
| US-4935516-A | Process for preparing 4-hydroxypyrimidine | UBE INDUSTRIES, LTD. (JP) | 1990-06-19 | — | — | US | claimed |
| EP-0326389-A2 | Process for preparing 4-hydroxypyrimidine | UBE INDUSTRIES, LTD. (JP) | 1989-08-02 | — | — | EP | claimed |
| CN-119331364-A | Special cable protective sleeve material for truck and preparation method thereof | 扬州诺恒特种线缆有限公司 | 2025-01-21 | — | — | CN | disclosed |
| CN-117659904-A | high-PID-resistance photovoltaic adhesive film and preparation method thereof | 江苏景宏新材料科技有限公司 | 2024-03-08 | — | — | CN | disclosed |
| CN-115261859-B | Copper etching liquid composition and preparation method thereof | 李祥庆 | 2023-06-20 | — | — | CN | disclosed |
| CN-114349694-B | Synthetic method of 4-trifluoromethyl nicotinic acid | 淮北龙溪生物科技有限公司 | 2022-11-08 | — | — | CN | disclosed |
| CN-115261859-A | Copper etching solution composition and preparation method thereof | 李祥庆 | 2022-11-01 | — | — | CN | disclosed |
| CN-115197651-A | Preparation method of Japanese paper account adhesive tape | 东莞市玛仕金科技有限公司 | 2022-10-18 | — | — | CN | disclosed |
| CN-114349694-A | Synthetic method of 4-trifluoromethyl nicotinic acid | 淮北龙溪生物科技有限公司 | 2022-04-15 | — | — | CN | disclosed |
| EP-2751076-B1 | SYNTHESIS METHOD AND INTERMEDIATES USEFUL IN THE PREPARATION OF PYRROLOBENZODIAZEPINES | MEDIMMUNE LTD (GB) | 2018-04-25 | — | — | EP | disclosed |
| EP-2558445-B1 | INTERMEDIATES USEFUL FOR THE SYNTHESIS OF PYRROLOBENZODIAZEPINES | MEDIMMUNE LTD (GB) | 2017-03-22 | — | — | EP | disclosed |
| CN-101460198-B | Thermosensitive polyphosphazene-bioactive molecule conjugate, preparation method and application thereof | KOREA INST SCI & TECH | 2013-08-07 | — | — | CN | disclosed |
| US-7563782-B2 | Optically active stereoisomer of efonidipine analogs; R-configuration of the 4-position on dihydropyridine ring; kidney insufficiency; hypercardia; congestive heart failure; cardiomyopathy; arterial sclerosis; antifibrillatory/antiarrhythmia agents; cardiovascular disorders; antiedemic/antiinflammatory | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2009-07-21 | — | — | US | disclosed |
| CN-101460198-A | Thermosensitive polyphosphazene-bioactive molecule conjugate, preparation method and application thereof | KOREA INST SCI & TECH (KR) | 2009-06-17 | — | — | CN | disclosed |
| EP-0326389-B1 | Process for preparing 4-hydroxypyrimidine | UBE INDUSTRIES (JP) | 1996-09-11 | — | — | EP | disclosed |
| US-4935516-A | Process for preparing 4-hydroxypyrimidine | UBE INDUSTRIES, LTD. (JP) | 1990-06-19 | — | — | US | disclosed |
| EP-0326389-A2 | Process for preparing 4-hydroxypyrimidine | UBE INDUSTRIES, LTD. (JP) | 1989-08-02 | — | — | EP | disclosed |