⚠ 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 | |
|---|---|---|---|---|
| Methane SCHEMBL9414714 | 0.98 | — | — | |
| SCHEMBL4448996 | 0.78 | — | — | |
| SCHEMBL28132668 | 0.76 | — | — | |
| Methane SCHEMBL10320030 | 0.76 | — | — | |
| SCHEMBL28986382 | 0.75 | — | — | |
| SCHEMBL28951683 | 0.74 | — | — | |
| SCHEMBL4370009 | 0.71 | — | — | |
| SCHEMBL27447163 | 0.71 | — | — | |
| SCHEMBL6859000 | 0.71 | — | — | |
| SCHEMBL28534980 | 0.71 | — | — |
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-115584262-A | Chemical etching composition and application thereof | 安集微电子（上海）有限公司 | 2023-01-10 | — | — | CN | claimed |
| CN-109428080-B | Negative electrode binder, negative electrode plate and lithium ion secondary battery | 宁德时代新能源科技股份有限公司 | 2020-11-06 | — | — | CN | claimed |