⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL2406915 | 0.89 | — | — | |
| SCHEMBL29150869 | 0.89 | — | — | |
| SCHEMBL28728910 | 0.89 | — | — | |
| SCHEMBL6522089 | 0.89 | — | — | |
| SCHEMBL820178 | 0.74 | ALDH1A1 (0.36) | — | |
| SCHEMBL496707 | 0.67 | — | — | |
| SCHEMBL10766696 | 0.67 | — | — | |
| SCHEMBL16013108 | 0.63 | — | — | |
| SCHEMBL1134251 | 0.63 | — | — | |
| SCHEMBL380084 | 0.56 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109012727-B | Half-metallic C4N3Nano plate and preparation method and application thereof | 南京晓庄学院 | 2021-03-23 | — | — | CN | claimed |
| CN-112331784-B | Film and use thereof | 广东聚华印刷显示技术有限公司 | 2023-01-31 | — | — | CN | disclosed |
| CN-109012727-B | Half-metallic C4N3Nano plate and preparation method and application thereof | 南京晓庄学院 | 2021-03-23 | — | — | CN | disclosed |
| CN-112331784-A | Film and use thereof | 广东聚华印刷显示技术有限公司 | 2021-02-05 | — | — | CN | disclosed |