⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL692809 | 0.95 | — | — | |
| Ethane SCHEMBL11857687 | 0.65 | — | — | |
| SCHEMBL1518002 | 0.65 | — | — | |
| Methyl Alcohol SCHEMBL9618555 | 0.62 | — | — | |
| SCHEMBL28529992 | 0.62 | — | — | |
| SCHEMBL28281416 | 0.61 | — | — | |
| SCHEMBL2016425 | 0.61 | — | — | |
| Methane SCHEMBL11869370 | 0.61 | — | — | |
| Bromide SCHEMBL5848420 | 0.61 | — | — | |
| Water SCHEMBL8525892 | 0.61 | — | — |
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-111386137-B | Intranasal delivery devices | 株式会社新日本科学 | 2023-06-27 | — | — | CN | disclosed |