⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15512181 | 0.97 | SMN1; SMN2 (0.50) | — | |
| SCHEMBL65010 | 0.97 | — | — | |
| SCHEMBL63918 | 0.97 | — | — | |
| SCHEMBL27382 | 0.97 | — | — | |
| SCHEMBL16197775 | 0.94 | SMN1; SMN2 (0.48) | — | |
| Methane SCHEMBL28488217 | 0.94 | — | — | |
| SCHEMBL4599613 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL3331961 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL9444026 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL2652402 | 0.94 | — | — |
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-109929113-A | A kind of electrode of lithium cell bonding siloxane oligomer and preparation method thereof | 湖北大学 | 2019-06-25 | — | — | CN | claimed |
| CN-109929113-A | A kind of electrode of lithium cell bonding siloxane oligomer and preparation method thereof | 湖北大学 | 2019-06-25 | — | — | CN | disclosed |