⚠ 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 SCHEMBL27575048 | 0.95 | TSHR (0.54) | — | |
| Cyclobutanol SCHEMBL7138284 | 0.91 | — | — | |
| SCHEMBL8611 | 0.88 | — | — | |
| Cyclopentanol SCHEMBL8945182 | 0.87 | — | — | |
| Ethane SCHEMBL18543108 | 0.84 | TSHR (0.54) | — | |
| Methyl Alcohol SCHEMBL28881851 | 0.83 | TSHR (0.77) | — | |
| Cyclohexanol SCHEMBL2165683 | 0.83 | — | — | |
| SCHEMBL3887255 | 0.82 | — | — | |
| SCHEMBL102859 | 0.82 | — | — | |
| SCHEMBL3890523 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4255301-A | HEAT RESISTANCE, PHOTOSTABILITY | ARGUS CHEMICAL CORPORATION (US) | 1981-03-10 | — | — | US | disclosed |