⚠ 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 | |
|---|---|---|---|---|
| 1,4-Dichlorobenzene SCHEMBL11243685 | 0.94 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL5191 | 0.94 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL6228832 | 0.89 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL5144812 | 0.89 | LMNA (0.89) | — | |
| 1,4-Dichlorobenzene SCHEMBL11577097 | 0.89 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL6230506 | 0.89 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL8166345 | 0.89 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL15668734 | 0.89 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL5414363 | 0.89 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL10603593 | 0.89 | — | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110396109-A | A kind of double pyrroles condense the synthetic method of boron naphthazine and its derivative | UNIV TIANJIN TECHNOLOGY | 2019-11-01 | — | — | CN | claimed |
| CN-109232623-A | A kind of synthetic method of boron aza-phenanthrenes and its derivative | 天津理工大学 | 2019-01-18 | — | — | CN | claimed |
| CN-108503657-A | Boron N doping polycyclic aromatic hydrocarbon and its synthetic method containing five-ring heterocycles and application | 天津理工大学 | 2018-09-07 | — | — | CN | claimed |
| CN-107353301-A | A kind of boron azepine aromatic compound and its synthetic method and application | 天津理工大学 | 2017-11-17 | — | — | CN | claimed |
| CN-110396109-A | A kind of double pyrroles condense the synthetic method of boron naphthazine and its derivative | UNIV TIANJIN TECHNOLOGY | 2019-11-01 | — | — | CN | disclosed |
| CN-109867690-A | Benzodiazepine boron heterocyclic pentylene compound and Organic Light Emitting Diode component | 元智大学 | 2019-06-11 | — | — | CN | disclosed |
| CN-109232623-A | A kind of synthetic method of boron aza-phenanthrenes and its derivative | 天津理工大学 | 2019-01-18 | — | — | CN | disclosed |
| CN-108774253-A | Based on a kind of small molecule organic solar battery material of boron azacyclo- and preparation method thereof | 华南理工大学 | 2018-11-09 | — | — | CN | disclosed |
| CN-108503657-A | Boron N doping polycyclic aromatic hydrocarbon and its synthetic method containing five-ring heterocycles and application | 天津理工大学 | 2018-09-07 | — | — | CN | disclosed |
| CN-107353301-A | A kind of boron azepine aromatic compound and its synthetic method and application | 天津理工大学 | 2017-11-17 | — | — | CN | disclosed |
| CN-106750064-A | A kind of preparation method of phenolic resin renewable at room temperature and its recovery process and application | 西安交通大学 | 2017-05-31 | — | — | CN | disclosed |
| CN-101623657-B | Catalyst systems and their use in metathesis reactions | LANXESS DEUTSCHLAND GMBH | 2013-11-06 | — | — | CN | disclosed |
| CN-101624428-B | Method for the reduction of the molecular weight of nitrile rubber | LANXESS DEUTSCHLAND GMBH | 2013-08-28 | — | — | CN | disclosed |
| CN-101624428-A | Method for the reduction of the molecular weight of nitrile rubber | LANXESS DEUTSCHLAND GMBH | 2010-01-13 | — | — | CN | disclosed |
| CN-101623657-A | Catalyst systems and their use in metathesis reactions | LANXESS DEUTSCHLAND GMBH | 2010-01-13 | — | — | CN | disclosed |