⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28075867 | 0.82 | — | — | |
| SCHEMBL27985612 | 0.82 | — | — | |
| SCHEMBL28900991 | 0.82 | — | — | |
| SCHEMBL27909786 | 0.73 | — | — | |
| SCHEMBL28704081 | 0.73 | — | — | |
| SCHEMBL28392030 | 0.73 | — | — | |
| SCHEMBL28843063 | 0.73 | — | — | |
| SCHEMBL28268571 | 0.73 | — | — | |
| SCHEMBL891302 | 0.71 | — | — | |
| SCHEMBL18249529 | 0.71 | — | — |
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-103575725-B | The method measuring aluminum in pure rhenium, calcium, cadmium, copper, magnesium, manganese and titanium elements content | 中国航空工业集团公司北京航空材料研究院 | 2016-07-06 | — | — | CN | disclosed |