⚠ 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 | |
|---|---|---|---|---|
| Barium SCHEMBL31529977 | 0.87 | — | — | |
| Barium SCHEMBL29354359 | 0.71 | — | — | |
| Selenium SCHEMBL9658408 | 0.71 | — | — | |
| Barium SCHEMBL30377382 | 0.71 | — | — | |
| SCHEMBL11134552 | 0.71 | — | — | |
| Selenium SCHEMBL413432 | 0.71 | — | — | |
| Selenium SCHEMBL44189 | 0.71 | — | — | |
| SCHEMBL11134550 | 0.71 | — | — | |
| Selenium SCHEMBL3725393 | 0.71 | — | — | |
| Barium SCHEMBL29350882 | 0.71 | — | — |
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-119841283-A | Quaternary selenium compound containing alkaline earth metal, quaternary selenium infrared nonlinear optical crystal, preparation method and application | 中国科学院新疆理化技术研究所 | 2025-04-18 | — | — | CN | claimed |
| CN-119841283-A | Quaternary selenium compound containing alkaline earth metal, quaternary selenium infrared nonlinear optical crystal, preparation method and application | 中国科学院新疆理化技术研究所 | 2025-04-18 | — | — | CN | disclosed |
| CN-119841283-A | Quaternary selenium compound containing alkaline earth metal, quaternary selenium infrared nonlinear optical crystal, preparation method and application | 中国科学院新疆理化技术研究所 | 2025-04-18 | — | — | CN | disclosed |