⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13602379 | 0.75 | — | — | |
| SCHEMBL13602395 | 0.75 | — | — | |
| SCHEMBL178547 | 0.72 | — | — | |
| SCHEMBL23252462 | 0.71 | — | — | |
| SCHEMBL20989342 | 0.69 | — | — | |
| SCHEMBL25659462 | 0.68 | — | — | |
| SCHEMBL15910070 | 0.67 | — | — | |
| SCHEMBL19415267 | 0.67 | — | — | |
| SCHEMBL19981282 | 0.67 | ALDH1A1 (0.32) | — | |
| SCHEMBL21887775 | 0.67 | ALDH1A1 (0.32) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023210569-A1 | NOVEL COMPOUND, CONJUGATED POLYMER AND METHOD FOR PRODUCING SAME, FILM FORMATION COMPOSITION, ORGANIC THIN FILM, AND ORGANIC SEMICONDUCTOR ELEMENT | 東ソー株式会社 | 2023-11-02 | — | — | WO | disclosed |
| EP-4015521-A1 | ORGANIC METAL COMPOUND, ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE HAVING THE COMPOUND | LG Display Co., Ltd. (KR) | 2022-06-22 | — | — | EP | disclosed |