⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL179717 | 0.87 | — | — | |
| Iodide SCHEMBL4652804 | 0.75 | — | — | |
| SCHEMBL28113749 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL301375 | 0.75 | — | — | |
| SCHEMBL28276419 | 0.61 | — | — | |
| SCHEMBL15939769 | 0.61 | — | — | |
| SCHEMBL217570 | 0.58 | — | — | |
| SCHEMBL4653851 | 0.58 | — | — | |
| SCHEMBL23451641 | 0.50 | — | — | |
| SCHEMBL10869296 | 0.50 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0181706-A1 | Hybrid organometallic compounds of In and ba and process for metal organic chemical vapour deposition | MORTON THIOKOL, INC. (US) | 1986-05-21 | — | — | EP | disclosed |