⚠ 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 SCHEMBL5361834 | 0.89 | — | — | |
| Fluoride SCHEMBL859299 | 0.87 | — | — | |
| Fluoride SCHEMBL1333828 | 0.87 | — | — | |
| Fluoride SCHEMBL859298 | 0.87 | — | — | |
| Fluoride SCHEMBL702227 | 0.87 | — | — | |
| Fluoride SCHEMBL7752166 | 0.87 | — | — | |
| Fluoride SCHEMBL775055 | 0.87 | — | — | |
| Fluoride SCHEMBL3952552 | 0.87 | — | — | |
| Fluoride SCHEMBL3300476 | 0.87 | — | — | |
| Fluoride SCHEMBL28537297 | 0.87 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104087755-B | A kind of recovery method of neodymium iron boron waste material rare earth elements | ANHUI UNIVERSITY OF TECHNOLOGY (CN) | 2016-01-13 | — | — | CN | disclosed |
| CN-104087755-A | Recovery method of rare earth elements in NdFeB (neodymium iron boron) waste materials | UNIV ANHUI TECHNOLOGY | 2014-10-08 | — | — | CN | disclosed |