⚠ 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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL1100064 | 1.00 | — | — | |
| Methyl Alcohol SCHEMBL27789398 | 1.00 | — | — | |
| Methyl Alcohol SCHEMBL28132148 | 0.91 | — | — | |
| Methyl Alcohol SCHEMBL3865171 | 0.91 | — | — | |
| Methyl Alcohol SCHEMBL3611022 | 0.91 | — | — | |
| Methyl Alcohol SCHEMBL27766445 | 0.84 | — | — | |
| Methylamine SCHEMBL27283413 | 0.80 | — | — | |
| Methyl Alcohol SCHEMBL1146592 | 0.80 | — | — | |
| Methylamine SCHEMBL3935959 | 0.80 | — | — | |
| Methylamine SCHEMBL38759 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4163695-A | OVERFLOWS, REFLUXING | PHILLIPS PETROLEUM COMPANY (US) | 1979-08-07 | — | — | US | disclosed |