⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9572440 | 0.86 | — | — | |
| SCHEMBL27553773 | 0.84 | ALDH1A1 (0.54) | — | |
| SCHEMBL37752 | 0.84 | — | — | |
| SCHEMBL16760619 | 0.83 | — | — | |
| Isopropylamine SCHEMBL15157599 | 0.83 | — | — | |
| SCHEMBL28311771 | 0.81 | — | — | |
| Methyl Alcohol SCHEMBL4194049 | 0.81 | — | — | |
| SCHEMBL6528410 | 0.81 | — | — | |
| SCHEMBL18154634 | 0.81 | — | — | |
| Rubidium SCHEMBL7045613 | 0.81 | — | — |
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-110655490-A | Halogenated imidazole compounds, preparation method and application | 重庆迈迪生医药科技有限公司 | 2020-01-07 | — | — | CN | disclosed |