⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3018 | 0.93 | — | — | |
| SCHEMBL27806195 | 0.86 | — | — | |
| SCHEMBL22830239 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL28335749 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL3656174 | 0.86 | — | — | |
| SCHEMBL23451793 | 0.86 | — | — | |
| SCHEMBL3480752 | 0.86 | — | — | |
| SCHEMBL15017942 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL28085077 | 0.86 | — | — | |
| Water SCHEMBL28089458 | 0.86 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102617317-B | Method for synthesizing pyrene-4,5,9,10-tetralone | UNIV SOUTH CHINA TECH | 2013-12-25 | — | — | CN | claimed |
| CN-102617317-A | Method for synthesizing pyrene-4,5,9,10-tetralone | UNIV SOUTH CHINA TECH | 2012-08-01 | — | — | CN | claimed |
| CN-109996776-A | The method for preparing (more) alkylating phenol | 帝斯曼知识产权资产管理有限公司 | 2019-07-09 | — | — | CN | disclosed |
| CN-106146276-B | A kind of method of phenol compound catalysis oxidation synthesis benzoquinone compound | 中国科学院金属研究所 | 2019-04-09 | — | — | CN | disclosed |
| CN-108430962-A | Intermolecular reaction of propargyl ether with dimethylfuran in the presence of gold (I) complex | 帝斯曼知识产权资产管理有限公司 | 2018-08-21 | — | — | CN | disclosed |
| CN-108140920-A | Magnesium air electrode for cell and magnesium air battery and aromatic compound and metal complex | 住友化学株式会社 | 2018-06-08 | — | — | CN | disclosed |
| CN-107272340-A | Colored curable resin composition | 住友化学株式会社 | 2017-10-20 | — | — | CN | disclosed |
| CN-107001209-A | The intermolecular reaction formation chroman based on alkynes and dimethyl furan in the presence of golden (I) complex compound | 帝斯曼知识产权资产管理有限公司 | 2017-08-01 | — | — | CN | disclosed |
| CN-106146276-A | A kind of method of phenol compound catalysis oxidative synthesis benzoquinone compound | 中国科学院金属研究所 | 2016-11-23 | — | — | CN | disclosed |
| CN-102617317-B | Method for synthesizing pyrene-4,5,9,10-tetralone | UNIV SOUTH CHINA TECH | 2013-12-25 | — | — | CN | disclosed |
| CN-102617317-A | Method for synthesizing pyrene-4,5,9,10-tetralone | UNIV SOUTH CHINA TECH | 2012-08-01 | — | — | CN | disclosed |