⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL743245 | 1.00 | — | — | |
| SCHEMBL975706 | 1.00 | — | — | |
| SCHEMBL8781675 | 1.00 | — | — | |
| SCHEMBL3772888 | 0.82 | — | — | |
| SCHEMBL10483629 | 0.82 | — | — | |
| SCHEMBL3786500 | 0.82 | — | — | |
| SCHEMBL3780348 | 0.82 | — | — | |
| SCHEMBL3771756 | 0.82 | — | — | |
| SCHEMBL491527 | 0.82 | — | — | |
| SCHEMBL10828561 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-106282561-B | A kind of method that ruthenium is removed in the iridium slag from rhodium | 金川集团股份有限公司 | 2018-02-13 | — | — | CN | disclosed |
| US-5639401-A | Process for the catalytic partial oxidation of hydrocarbons | SHELL OIL COMPANY (US) | 1997-06-17 | — | — | US | disclosed |