⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21173224 | 0.81 | LCK (0.36) | — | |
| SCHEMBL25656471 | 0.81 | LCK (0.36) | — | |
| SCHEMBL25747895 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL25656468 | 0.69 | MAPT (0.39) | — | |
| SCHEMBL24960476 | 0.69 | MAPT (0.36) | — | |
| SCHEMBL21173228 | 0.69 | USP8 (0.40) | — | |
| SCHEMBL13981401 | 0.67 | MAPT (0.38) | — | |
| SCHEMBL25910287 | 0.67 | MAPT (0.37) | — | |
| SCHEMBL24960484 | 0.67 | MAPT (0.36) | — | |
| SCHEMBL25906014 | 0.67 | — | — |
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-2023120359-A1 | COMPOUND AND PHOTOELECTRIC CONVERSION ELEMENT USING SAME | 住友化学株式会社 | 2023-06-29 | — | — | WO | disclosed |
| WO-2023100844-A1 | COMPOUND AND PHOTOELECTRIC CONVERSION ELEMENT EMPLOYING SAME | 住友化学株式会社 | 2023-06-08 | — | — | WO | disclosed |