⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL150461 | 1.00 | — | — | |
| SCHEMBL25366216 | 1.00 | — | — | |
| SCHEMBL150462 | 1.00 | — | — | |
| SCHEMBL27939956 | 1.00 | — | — | |
| SCHEMBL23199792 | 0.82 | — | — | |
| Water SCHEMBL23921959 | 0.82 | — | — | |
| SCHEMBL23199760 | 0.82 | — | — | |
| SCHEMBL21774937 | 0.82 | — | — | |
| SCHEMBL23199793 | 0.82 | — | — | |
| SCHEMBL23199768 | 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 |
|---|---|---|---|---|---|---|---|
| CN-104592964-A | Method for preparing oil well cementing test block resistant to high temperatures and high pressures from silicozirconium ceramic microspheres | UNIV SHANDONG TECHNOLOGY | 2015-05-06 | — | — | CN | disclosed |