⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL476030 | 0.83 | — | — | |
| SCHEMBL476031 | 0.83 | — | — | |
| SCHEMBL5969099 | 0.83 | — | — | |
| SCHEMBL476096 | 0.78 | — | — | |
| SCHEMBL476095 | 0.78 | — | — | |
| SCHEMBL2163222 | 0.78 | — | — | |
| SCHEMBL2163220 | 0.78 | — | — | |
| SCHEMBL261531 | 0.78 | — | — | |
| SCHEMBL261532 | 0.78 | — | — | |
| SCHEMBL6200021 | 0.78 | — | — |
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-4202816-A | ENOL-PIPERIDINE METAL COMPLEXES | CIBA-GEIGY CORPORATION (US) | 1980-05-13 | — | — | US | disclosed |