⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29136453 | 0.79 | — | — | |
| SCHEMBL3481972 | 0.77 | ALDH1A1 (0.30) | — | |
| SCHEMBL339814 | 0.74 | — | — | |
| SCHEMBL27606642 | 0.74 | — | — | |
| SCHEMBL339028 | 0.72 | — | — | |
| SCHEMBL10005616 | 0.72 | — | — | |
| SCHEMBL8421919 | 0.72 | — | — | |
| SCHEMBL10005615 | 0.70 | — | — | |
| SCHEMBL16673152 | 0.70 | — | — | |
| SCHEMBL1577808 | 0.70 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117120534-A | Composition for encapsulant film and encapsulant film comprising same | 株式会社LG化学 | 2023-11-24 | — | — | CN | claimed |
| CN-117120534-A | Composition for encapsulant film and encapsulant film comprising same | 株式会社LG化学 | 2023-11-24 | — | — | CN | disclosed |
| CN-111094499-B | Thermally conductive composition | 美国陶氏有机硅公司 | 2022-10-28 | — | — | CN | disclosed |