⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17717851 | 0.85 | — | — | |
| SCHEMBL29312866 | 0.77 | TRPM4 (0.37) | — | |
| SCHEMBL14069628 | 0.76 | TRPM4 (0.42) | — | |
| SCHEMBL12012670 | 0.75 | TRPM4 (0.41) | — | |
| SCHEMBL13721283 | 0.75 | ALDH1A1 (0.42) | — | |
| SCHEMBL15730661 | 0.75 | ALDH1A1 (0.42) | — | |
| SCHEMBL13720442 | 0.75 | ALDH1A1 (0.42) | — | |
| SCHEMBL12333196 | 0.75 | ALDH1A1 (0.42) | — | |
| SCHEMBL9888888 | 0.75 | TRPM4 (0.43) | — | |
| SCHEMBL14369635 | 0.74 | SIGMAR1 (0.36) | — |
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-3647392-B1 | LIGHT-EMITTING MATERIAL, COMPOUND, LONG-PERSISTENT PHOSPHOR AND LIGHT-EMITTING ELEMENT | KYULUX INC (JP) | 2021-09-08 | — | — | EP | disclosed |