⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2387143 | 0.82 | — | — | |
| SCHEMBL870092 | 0.82 | — | — | |
| SCHEMBL1004887 | 0.82 | — | — | |
| SCHEMBL3757468 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL11803059 | 0.67 | — | — | |
| SCHEMBL10489017 | 0.67 | — | — | |
| SCHEMBL15174019 | 0.67 | — | — | |
| SCHEMBL10489020 | 0.67 | — | — | |
| Fluoride SCHEMBL11752271 | 0.67 | — | — | |
| SCHEMBL17456010 | 0.67 | — | — |
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-20100124523-A1 | Emissions Treatment Catalysts | BASF CATALYSTS LLC (US) | 2010-05-20 | — | — | US | disclosed |