⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21352596 | 0.91 | — | — | |
| SCHEMBL2023044 | 0.89 | — | — | |
| SCHEMBL998931 | 0.89 | — | — | |
| SCHEMBL21352613 | 0.84 | — | — | |
| SCHEMBL21352590 | 0.84 | — | — | |
| SCHEMBL22551321 | 0.80 | — | — | |
| SCHEMBL737694 | 0.80 | — | — | |
| SCHEMBL29208450 | 0.80 | — | — | |
| SCHEMBL3757411 | 0.80 | — | — | |
| SCHEMBL29159172 | 0.80 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116750748-A | Method for preparing metal element doped mesophase carbon microsphere | 中国石油大学(华东) | 2023-09-15 | — | — | CN | disclosed |