⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10800865 | 0.97 | — | — | |
| SCHEMBL17470 | 0.97 | — | — | |
| SCHEMBL3678159 | 0.97 | TSHR (0.55) | — | |
| SCHEMBL28800526 | 0.93 | CES2 (0.53) | — | |
| SCHEMBL8572541 | 0.93 | — | — | |
| SCHEMBL31573958 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL15821164 | 0.93 | — | — | |
| Water SCHEMBL15821216 | 0.93 | — | — | |
| SCHEMBL29595740 | 0.93 | CES2 (0.53) | — | |
| SCHEMBL196473 | 0.93 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108566735-B | Array copper oxide semiconductor sensor and preparation method and application thereof | 中国科学院福建物质结构研究所 | 2020-06-09 | — | — | CN | disclosed |
| CN-106700735-B | Particle-free conductive copper ink capable of being heated in air and preparation and use methods thereof | 东北大学 | 2020-06-02 | — | — | CN | disclosed |