⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL935083 | 1.00 | — | — | |
| SCHEMBL9133884 | 1.00 | — | — | |
| SCHEMBL30508 | 1.00 | — | — | |
| SCHEMBL27325754 | 1.00 | — | — | |
| SCHEMBL9776951 | 1.00 | — | — | |
| SCHEMBL3579 | 1.00 | — | — | |
| SCHEMBL5692214 | 1.00 | — | — | |
| SCHEMBL15676633 | 1.00 | — | — | |
| SCHEMBL23923267 | 0.91 | — | — | |
| Fluoride SCHEMBL11426308 | 0.91 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108079369-A | Silicate cement bracket with surface nano-structure and its preparation method and application | 中国科学院上海硅酸盐研究所 | 2018-05-29 | — | — | CN | disclosed |
| WO-2000024688-A1 | HYDRAULICALLY REACTIVE PARTICLES AND METHODS FOR THEIR MANUFACTURE | E. KHASHOGGI INDUSTRIES LLC. (US) | 2000-05-04 | — | — | WO | disclosed |