⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28197161 | 0.87 | — | — | |
| SCHEMBL28251497 | 0.82 | — | — | |
| SCHEMBL136705 | 0.82 | — | — | |
| SCHEMBL29220753 | 0.82 | — | — | |
| SCHEMBL8536222 | 0.82 | — | — | |
| SCHEMBL30128291 | 0.67 | — | — | |
| SCHEMBL28071893 | 0.67 | — | — | |
| SCHEMBL31501065 | 0.67 | — | — | |
| SCHEMBL31501064 | 0.67 | — | — | |
| SCHEMBL27789201 | 0.67 | — | — |
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-207134974-U | A kind of liquid metal electromagnetic pump | 云南靖创液态金属热控技术研发有限公司 | 2018-03-23 | — | — | CN | claimed |