⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28041906 | 0.78 | — | — | |
| SCHEMBL4860097 | 0.73 | SCN5A (0.32) | — | |
| SCHEMBL7626799 | 0.73 | — | — | |
| SCHEMBL4859506 | 0.71 | ALDH1A1 (0.46) | — | |
| SCHEMBL3325277 | 0.69 | — | — | |
| SCHEMBL7632573 | 0.69 | — | — | |
| SCHEMBL4859546 | 0.69 | RAPGEF4 (0.36) | — | |
| SCHEMBL29126221 | 0.68 | — | — | |
| SCHEMBL8173238 | 0.67 | CYP3A4 (0.44) | — | |
| SCHEMBL29590472 | 0.67 | ALDH1A1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109791358-B | Photosensitive composition, colored pattern and method for producing the same | 株式会社钟化 | 2022-09-02 | — | — | CN | disclosed |