⚠ 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 | |
|---|---|---|---|---|
| Methane SCHEMBL5858457 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL3797560 | 0.82 | — | — | |
| Methane SCHEMBL10860335 | 0.82 | — | — | |
| Methane SCHEMBL600032 | 0.82 | — | — | |
| Methane SCHEMBL21611348 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL907559 | 0.82 | — | — | |
| Methane SCHEMBL1021481 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL176834 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL887056 | 0.82 | — | — | |
| Methane SCHEMBL28794829 | 0.82 | — | — |
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-114752957-A | Self-assembled high-stability carbon-nitrogen-loaded ruthenium-anchored fullerene electrocatalyst and preparation method and application thereof | 陕西科技大学 | 2022-07-15 | — | — | CN | claimed |
| CN-117643910-A | Monoatomic porous material catalyst, preparation method and application thereof in anaerobic conversion reaction of methane | 大连医科大学 | 2024-03-05 | — | — | CN | disclosed |