⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5277347 | 0.85 | ALDH1A1 (0.39) | — | |
| SCHEMBL11297200 | 0.83 | ALDH1A1 (0.38) | — | |
| SCHEMBL15059128 | 0.83 | ALDH1A1 (0.38) | — | |
| SCHEMBL5278601 | 0.83 | ALDH1A1 (0.38) | — | |
| SCHEMBL17013649 | 0.80 | ALDH1A1 (0.32) | — | |
| SCHEMBL1778962 | 0.78 | — | — | |
| SCHEMBL9119251 | 0.78 | — | — | |
| Ether SCHEMBL11060015 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL14795326 | 0.75 | — | — | |
| SCHEMBL1368680 | 0.75 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113398010-B | Intelligent temperature-sensitive hair dye capable of reducing aniline substances from entering human body and preparation method of intelligent temperature-sensitive hair dye | 江南大学 | 2022-03-04 | — | — | CN | claimed |
| CN-113398010-A | Intelligent temperature-sensitive hair dye capable of reducing aniline substances from entering human body and preparation method of intelligent temperature-sensitive hair dye | 江南大学 | 2021-09-17 | — | — | CN | claimed |
| CN-120081966-A | Application method of composite external electron donor for controlling ethylene polymerization hydrogen regulation and comonomer distribution | 中化泉州石化有限公司 | 2025-06-03 | — | — | CN | disclosed |
| CN-117603242-A | Preparation method of trans-1-ethoxyvinyl-2-boric acid pinacol ester | 沧州普瑞东方科技有限公司 | 2024-02-27 | — | — | CN | disclosed |
| CN-109761761-B | Preparation method of ethoxypropylene | 山东国邦药业股份有限公司 | 2022-06-14 | — | — | CN | disclosed |
| CN-113398010-B | Intelligent temperature-sensitive hair dye capable of reducing aniline substances from entering human body and preparation method of intelligent temperature-sensitive hair dye | 江南大学 | 2022-03-04 | — | — | CN | disclosed |
| CN-113398010-A | Intelligent temperature-sensitive hair dye capable of reducing aniline substances from entering human body and preparation method of intelligent temperature-sensitive hair dye | 江南大学 | 2021-09-17 | — | — | CN | disclosed |
| CN-109761761-A | A kind of preparation method of ethoxy propylene | 山东国邦药业股份有限公司 | 2019-05-17 | — | — | CN | disclosed |
| EP-3066094-A1 | PYRAZOLE FOR THE TREATMENT AUTOIMMUNE DISORDERS | Takeda Pharmaceutical Company Limited (JP) | 2016-09-14 | — | — | EP | disclosed |
| WO-2015068856-A1 | PYRAZOLE FOR THE TREATMENT AUTOIMMUNE DISORDERS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2015-05-14 | — | — | WO | disclosed |
| EP-1143991-A2 | INHIBITORS OF H+K+ -ATPASE | Advanced Medicine, Inc. (US) | 2001-10-17 | — | — | EP | disclosed |
| WO-1999063940-A2 | INHIBITORS OF H+K+-ATPase | ADVANCED MEDICINE, INC. (US) | 1999-12-16 | — | — | WO | disclosed |
| US-4624951-A | Substituted pyridazinones, pharmaceutical preparations containing these compounds, and the use thereof | CIBA-GEIGY CORPORATION (US) | 1986-11-25 | — | — | US | disclosed |