⚠ 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 SCHEMBL28057083 | 0.94 | — | — | |
| SCHEMBL21951384 | 0.94 | — | — | |
| SCHEMBL320075 | 0.94 | — | — | |
| SCHEMBL28301602 | 0.88 | — | — | |
| Water SCHEMBL27716777 | 0.88 | — | — | |
| Water SCHEMBL2377989 | 0.88 | — | — | |
| SCHEMBL16782937 | 0.88 | — | — | |
| SCHEMBL21951833 | 0.80 | — | — | |
| SCHEMBL21951704 | 0.80 | — | — | |
| SCHEMBL21951192 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4472248-A | Method of making thin-film magnetic recording medium having perpendicular anisotropy | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1984-09-18 | — | — | US | disclosed |