⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL28503240 | 1.00 | — | — | |
| Fluoride SCHEMBL29205669 | 0.98 | — | — | |
| SCHEMBL1322274 | 0.98 | — | — | |
| SCHEMBL4864221 | 0.98 | — | — | |
| SCHEMBL206748 | 0.98 | — | — | |
| SCHEMBL205693 | 0.98 | — | — | |
| SCHEMBL28471304 | 0.98 | — | — | |
| SCHEMBL25214803 | 0.96 | — | — | |
| Methyl Alcohol SCHEMBL28351401 | 0.94 | — | — | |
| Cyclohexane SCHEMBL29061190 | 0.93 | — | — |
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-117946656-A | Amphiphobic fracturing propping agent and preparation method thereof | 北京昆仑隆源石油开采技术有限公司 | 2024-04-30 | — | — | CN | disclosed |