⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL27658417 | 0.97 | ALDH1A1 (0.48) | — | |
| SCHEMBL374821 | 0.97 | — | — | |
| Iodide SCHEMBL30510675 | 0.94 | — | — | |
| SCHEMBL17456489 | 0.94 | — | — | |
| Water SCHEMBL6689986 | 0.94 | — | — | |
| SCHEMBL28934634 | 0.94 | — | — | |
| SCHEMBL17456377 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL833018 | 0.94 | — | — | |
| Sulfuric Acid SCHEMBL28899813 | 0.91 | ALDH1A1 (0.48) | — | |
| Hydrazine SCHEMBL6709964 | 0.91 | ALDH1A1 (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1675135-B1 | Iron nitride system magnetic powder having good storage stability | DOWA ELECTRONICS MATERIALS CO LTD (JP) | 2009-01-07 | — | — | EP | disclosed |