⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25135325 | 0.85 | — | — | |
| SCHEMBL22641966 | 0.79 | ALDH1A1 (0.34) | — | |
| SCHEMBL13757295 | 0.78 | KDM4E (0.36) | — | |
| SCHEMBL4926948 | 0.76 | KDM4E (0.36) | — | |
| SCHEMBL10055307 | 0.75 | KDM4E (0.33) | — | |
| SCHEMBL22385570 | 0.73 | — | — | |
| SCHEMBL29454044 | 0.73 | IMPDH2 (0.47) | — | |
| SCHEMBL29362692 | 0.73 | IMPDH2 (0.47) | — | |
| SCHEMBL16865110 | 0.73 | IMPDH2 (0.47) | — | |
| SCHEMBL10055249 | 0.72 | KDM4E (0.35) | — |
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-A1 | LIGHT-EMITTING MATERIAL, COMPOUND, LONG-PERSISTENT PHOSPHOR AND LIGHT-EMITTING ELEMENT | Kyulux, Inc. (JP) | 2020-05-06 | — | — | EP | disclosed |