⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15121263 | 0.84 | — | — | |
| SCHEMBL31695378 | 0.80 | — | — | |
| SCHEMBL2289772 | 0.77 | — | — | |
| SCHEMBL15121231 | 0.77 | — | — | |
| SCHEMBL8034932 | 0.71 | ALDH1A1 (0.37) | — | |
| Butane SCHEMBL872149 | 0.69 | — | — | |
| SCHEMBL11388050 | 0.67 | TSHR (0.36) | — | |
| SCHEMBL10928079 | 0.66 | — | — | |
| SCHEMBL11363024 | 0.66 | TSHR (0.35) | — | |
| SCHEMBL4608718 | 0.66 | TSHR (0.35) | — |
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 190 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20250313526-A1 | PYRETHROID COMPOUND CONTAINING DOUBLE BONDS AND CYANO GROUPS, SYNTHESIS METHOD THEREFOR, AND APPLICATION THEREOF | JIANGSU YANGNONG CHEMICAL CO., LTD. (CN) | 2025-10-09 | — | — | US | claimed |
| CN-117790909-A | Lithium ion battery electrolyte and preparation method thereof | 贵州兴锂新能源科技有限公司 | 2024-03-29 | — | — | CN | claimed |
| CN-117658827-A | Synthesis method of alkyl cyclohexylethylamine | 上海睿智化学研究有限公司 | 2024-03-08 | — | — | CN | claimed |
| CN-114914536-A | Electrolyte for lithium battery, and method for improving performance of high-temperature lithium battery | 中国科学院物理研究所 | 2022-08-16 | — | — | CN | claimed |
| US-9447362-B2 | Nitrile compound | KAO CORPORATION (JP) | 2016-09-20 | — | — | US | claimed |
| US-20150353480-A1 | NITRILE COMPOUND | KAO CORPORATION (JP) | 2015-12-10 | — | — | US | claimed |
| EP-2940005-A1 | NITRILE COMPOUND | Kao Corporation (JP) | 2015-11-04 | — | — | EP | claimed |
| US-20130005771-A1 | OXADIAZOLE COMPOUNDS, THEIR PREPARATION AND USE | Piramal Enterprises Limited (IN) | 2013-01-03 | — | — | US | claimed |
| EP-2539327-A1 | OXADIAZOLE COMPOUNDS, THEIR PREPARATION AND USE | Piramal Enterprises Limited (IN) | 2013-01-02 | — | — | EP | claimed |
| WO-2011104680-A1 | OXADIAZOLE COMPOUNDS, THEIR PREPARATION AND USE | PIRAMAL LIFE SCIENCES LIMITED (IN) | 2011-09-01 | — | — | WO | claimed |
| WO-2010045565-A1 | PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2010-04-22 | — | — | WO | claimed |
| US-20250313526-A1 | PYRETHROID COMPOUND CONTAINING DOUBLE BONDS AND CYANO GROUPS, SYNTHESIS METHOD THEREFOR, AND APPLICATION THEREOF | JIANGSU YANGNONG CHEMICAL CO., LTD. (CN) | 2025-10-09 | — | — | US | disclosed |
| US-20250313526-A1 | PYRETHROID COMPOUND CONTAINING DOUBLE BONDS AND CYANO GROUPS, SYNTHESIS METHOD THEREFOR, AND APPLICATION THEREOF | JIANGSU YANGNONG CHEMICAL CO., LTD. (CN) | 2025-10-09 | — | — | US | disclosed |
| CN-118307534-A | LTA4H inhibitors and uses thereof | 上海海雁医药科技有限公司 | 2024-07-09 | — | — | CN | disclosed |
| CN-118265411-A | Hole transport layer material for perovskite solar cell, perovskite solar cell and preparation method | 北京曜能科技有限公司 | 2024-06-28 | — | — | CN | disclosed |
| EP-0018893-B1 | ALLETHROLONE DERIVATIVES AND PROCESS FOR THEIR PREPARATION | ROUSSEL-UCLAF (FR) | 1983-01-26 | — | — | EP | disclosed |
| EP-0018894-B1 | ESTERS OF ALLETHROLONE DERIVATIVES AND CARBOXYLIC ACIDS, PROCESS FOR THEIR PREPARATION AND THE COMPOSITIONS CONTAINING THEM | ROUSSEL-UCLAF (FR) | 1982-02-17 | — | — | EP | disclosed |
| EP-0037310-A1 | Substituted deoxyadenosine derivatives | MERRELL TORAUDE ET COMPAGNIE (FR) | 1981-10-07 | — | — | EP | disclosed |
| EP-0018893-A1 | Allethrolone derivatives and process for their preparation | ROUSSEL-UCLAF (FR) | 1980-11-12 | — | — | EP | disclosed |
| EP-0018894-A1 | Esters of allethrolone derivatives and carboxylic acids, process for their preparation and the compositions containing them | ROUSSEL-UCLAF (FR) | 1980-11-12 | — | — | EP | disclosed |