⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28793720 | 0.91 | — | — | |
| SCHEMBL1000518 | 0.91 | — | — | |
| SCHEMBL998931 | 0.89 | — | — | |
| SCHEMBL160067 | 0.89 | — | — | |
| SCHEMBL998655 | 0.84 | — | — | |
| SCHEMBL27861903 | 0.84 | — | — | |
| SCHEMBL6891666 | 0.80 | — | — | |
| Methane SCHEMBL4069563 | 0.80 | — | — | |
| SCHEMBL15844256 | 0.80 | — | — | |
| SCHEMBL3189769 | 0.80 | — | — |
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-117815901-B | Filling type reactor for catalytic purification of carbon monoxide in fire smoke | 重庆大学 | 2024-08-06 | — | — | CN | disclosed |
| CN-117815901-A | Filling type reactor for catalytic purification of carbon monoxide in fire smoke | 重庆大学 | 2024-04-05 | — | — | CN | disclosed |