⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28032085 | 0.87 | — | — | |
| SCHEMBL27280353 | 0.87 | — | — | |
| SCHEMBL29204155 | 0.87 | — | — | |
| SCHEMBL6425743 | 0.87 | — | — | |
| SCHEMBL25415121 | 0.75 | — | — | |
| SCHEMBL6425696 | 0.75 | — | — | |
| SCHEMBL1419724 | 0.75 | — | — | |
| Methane SCHEMBL28444965 | 0.75 | — | — | |
| SCHEMBL28850491 | 0.75 | — | — | |
| SCHEMBL28847660 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-106669725-A | Preparation method of multi-component compound oxide catalyst composition for treating methylene blue wastewater | 湖北工业大学 | 2017-05-17 | — | — | CN | disclosed |