⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4076073 | 0.77 | ESR1 (0.33) | — | |
| SCHEMBL23764130 | 0.74 | SIGMAR1 (0.37) | — | |
| SCHEMBL17012368 | 0.71 | MAPT (0.35) | — | |
| SCHEMBL23764267 | 0.71 | SIGMAR1 (0.38) | — | |
| SCHEMBL4078698 | 0.69 | MCL1 (0.33) | — | |
| SCHEMBL16484345 | 0.69 | MEN1 (0.34) | — | |
| SCHEMBL13090016 | 0.69 | CYP2A6 (0.33) | — | |
| SCHEMBL17132489 | 0.69 | CYP11B1 (0.37) | — | |
| SCHEMBL13510697 | 0.68 | ALDH1A1 (0.38) | — | |
| SCHEMBL13510699 | 0.67 | ALDH1A1 (0.40) | — |
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-2907803-B1 | FLUORANTHENE DERIVATIVE, LUMINESCENT ELEMENT MATERIAL CONTAINING SAME, AND LUMINESCENT ELEMENT | TORAY INDUSTRIES (JP) | 2021-08-18 | — | — | EP | disclosed |