⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26440613 | 0.93 | — | — | |
| SCHEMBL26440676 | 0.92 | KDM4E (0.30) | — | |
| SCHEMBL26440762 | 0.90 | — | — | |
| SCHEMBL26440856 | 0.88 | — | — | |
| SCHEMBL24752541 | 0.81 | ALOX5 (0.36) | — | |
| SCHEMBL20465202 | 0.80 | — | — | |
| SCHEMBL8737843 | 0.79 | — | — | |
| SCHEMBL24752192 | 0.79 | KDM4E (0.35) | — | |
| SCHEMBL24788929 | 0.79 | PTGER4 (0.36) | — | |
| SCHEMBL25533697 | 0.79 | MEN1 (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 |
|---|---|---|---|---|---|---|---|
| US-20230127629-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE | IDEMITSU KOSAN CO.,LTD. (JP) | 2023-04-27 | — | — | US | disclosed |