⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28084561 | 0.76 | — | — | |
| SCHEMBL8816870 | 0.72 | — | — | |
| SCHEMBL8226865 | 0.68 | — | — | |
| SCHEMBL29275518 | 0.67 | DNTT (0.37) | — | |
| SCHEMBL31243577 | 0.67 | CYP3A4 (0.44) | — | |
| SCHEMBL25328751 | 0.65 | CYP3A4 (0.30) | — | |
| SCHEMBL31317674 | 0.64 | — | — | |
| SCHEMBL28398659 | 0.63 | — | — | |
| SCHEMBL9419521 | 0.62 | — | — | |
| SCHEMBL7189585 | 0.61 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111945466-B | Water-stick gummed paper and preparation method thereof | 广东冠豪高新技术股份有限公司 | 2024-06-07 | — | — | CN | claimed |
| CN-111518083-B | Preparation and application of open type fluorescent probe for detecting carbon monoxide | 湘潭大学 | 2022-06-28 | — | — | CN | claimed |
| CN-114315691-A | Asymmetric squarylium cyanine colorimetric probe for identifying copper ions and application thereof | 常州大学 | 2022-04-12 | — | — | CN | claimed |
| CN-111945466-B | Water-stick gummed paper and preparation method thereof | 广东冠豪高新技术股份有限公司 | 2024-06-07 | — | — | CN | disclosed |
| CN-114507109-B | Method for synthesizing bibenzyl compound by photocatalysis | 苏州大学张家港工业技术研究院 | 2023-06-23 | — | — | CN | disclosed |
| CN-114481698-B | Cross-linked water-based coating of thermosensitive paper, thermosensitive paper and preparation method of thermosensitive paper | 广东冠豪高新技术股份有限公司 | 2023-05-09 | — | — | CN | disclosed |
| CN-111518083-B | Preparation and application of open type fluorescent probe for detecting carbon monoxide | 湘潭大学 | 2022-06-28 | — | — | CN | disclosed |
| CN-112266351-B | Two-photon ratio fluorescent probe and preparation method and application thereof | 山东师范大学 | 2022-04-15 | — | — | CN | disclosed |
| CN-114315691-A | Asymmetric squarylium cyanine colorimetric probe for identifying copper ions and application thereof | 常州大学 | 2022-04-12 | — | — | CN | disclosed |