⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3206479 | 0.72 | — | — | |
| SCHEMBL8629337 | 0.65 | — | — | |
| SCHEMBL8465190 | 0.65 | — | — | |
| SCHEMBL10585017 | 0.65 | — | — | |
| SCHEMBL3215773 | 0.65 | — | — | |
| SCHEMBL7719617 | 0.62 | — | — | |
| SCHEMBL8330792 | 0.61 | — | — | |
| SCHEMBL7676380 | 0.61 | — | — | |
| SCHEMBL7672771 | 0.61 | — | — | |
| SCHEMBL9642135 | 0.61 | — | — |
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-4323563-A | PURIFICATION OF PHOSPHOLIPIOS AND PARTIAL HYDROGENATION | AJINOMOTO CO., INC. (JP) | 1982-04-06 | — | — | US | disclosed |