⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3899839 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL28207694 | 0.80 | — | — | |
| SCHEMBL5881395 | 0.77 | — | — | |
| Fluoride SCHEMBL27930929 | 0.75 | TSHR (0.33) | — | |
| Pyrrole SCHEMBL28080443 | 0.68 | — | — | |
| Benzene SCHEMBL29028947 | 0.68 | — | — | |
| SCHEMBL15302307 | 0.67 | TP53 (0.38) | — | |
| SCHEMBL13532300 | 0.67 | — | — | |
| SCHEMBL31191624 | 0.65 | — | — | |
| Pyrrole SCHEMBL28527840 | 0.65 | — | — |
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-103374708-B | High temperature atomic layer deposition of silicon oxide thin films | 气体产品与化学公司 | 2017-05-17 | — | — | CN | disclosed |