⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5041664 | 1.00 | — | — | |
| SCHEMBL28401793 | 0.79 | — | — | |
| SCHEMBL5655223 | 0.79 | — | — | |
| SCHEMBL25404805 | 0.75 | — | — | |
| SCHEMBL31124664 | 0.75 | — | — | |
| SCHEMBL16908300 | 0.75 | — | — | |
| SCHEMBL31358569 | 0.75 | — | — | |
| SCHEMBL11711348 | 0.75 | — | — | |
| SCHEMBL31555009 | 0.75 | — | — | |
| SCHEMBL19699877 | 0.75 | — | — |
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-118702694-A | N-type organic positive electrode material and preparation method and application thereof | 上海电力大学 | 2024-09-27 | — | — | CN | claimed |
| CN-118702694-A | N-type organic positive electrode material and preparation method and application thereof | 上海电力大学 | 2024-09-27 | — | — | CN | disclosed |