⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22616771 | 0.85 | — | — | |
| SCHEMBL8660698 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL15124680 | 0.67 | — | — | |
| SCHEMBL6012041 | 0.66 | — | — | |
| SCHEMBL9440602 | 0.63 | — | — | |
| SCHEMBL29495013 | 0.63 | — | — | |
| SCHEMBL28657902 | 0.63 | — | — | |
| SCHEMBL22616755 | 0.62 | — | — | |
| SCHEMBL29495034 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL29495010 | 0.62 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220259231-A1 | METAL-LIGAND COMPLEXES | DOW GLOBAL TECHNOLOGIES LLC (US) | 2022-08-18 | — | — | US | disclosed |
| WO-2020223142-A1 | METAL-LIGAND COMPLEXES | DOW GLOBAL TECHNOLOGIES LLC (US) | 2020-11-05 | — | — | WO | disclosed |