⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28055491 | 0.78 | — | — | |
| SCHEMBL22809210 | 0.73 | — | — | |
| SCHEMBL1782950 | 0.71 | — | — | |
| SCHEMBL22510137 | 0.71 | — | — | |
| SCHEMBL21010551 | 0.71 | — | — | |
| SCHEMBL12532777 | 0.70 | — | — | |
| SCHEMBL25446646 | 0.69 | — | — | |
| SCHEMBL51411 | 0.64 | — | — | |
| SCHEMBL23785240 | 0.63 | — | — | |
| SCHEMBL17183320 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4242196-A1 | METHOD FOR PREPARING DEUTERATED ANTHRACENE COMPOUND, REACTION COMPOSITION, DEUTERATED ANTHRACENE COMPOUND AND COMPOSITION | Lg Chem, Ltd. (KR) | 2023-09-13 | — | — | EP | disclosed |