⚠ 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 | |
|---|---|---|---|---|
| Silver SCHEMBL16791924 | 0.89 | — | — | |
| SCHEMBL6915095 | 0.89 | — | — | |
| SCHEMBL6909188 | 0.89 | — | — | |
| SCHEMBL10891180 | 0.89 | — | — | |
| SCHEMBL6915448 | 0.89 | CA4 (0.46) | — | |
| Zinc Ion SCHEMBL6915671 | 0.89 | — | — | |
| SCHEMBL6913128 | 0.89 | CA4 (0.46) | — | |
| SCHEMBL11728235 | 0.89 | CA4 (0.46) | — | |
| SCHEMBL6917485 | 0.89 | CA4 (0.46) | — | |
| SCHEMBL31490697 | 0.89 | — | — |
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-4008266-A | Coupling of aromatic compounds in the presence of molecular oxygen, a mercuric oxyanion compound, and a group VIII metal or group VIII metal oxyanion compound | MONSANTO COMPANY (US) | 1977-02-15 | — | — | US | disclosed |