⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8080642 | 0.74 | — | — | |
| SCHEMBL14751187 | 0.72 | — | — | |
| SCHEMBL21100089 | 0.72 | — | — | |
| SCHEMBL324702 | 0.72 | — | — | |
| SCHEMBL239610 | 0.72 | — | — | |
| SCHEMBL5887685 | 0.71 | ALDH1A1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL1863919 | 0.69 | — | — | |
| SCHEMBL13533928 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL635546 | 0.69 | — | — | |
| SCHEMBL7321505 | 0.69 | — | — |
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-116075603-A | Group 4 metal element-containing compound, precursor composition containing same, and method for producing thin film using same | 韩松化学株式会社 | 2023-05-05 | — | — | CN | disclosed |