⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL725241 | 1.00 | — | — | |
| SCHEMBL10732731 | 0.82 | — | — | |
| Fluoride Ion SCHEMBL4890463 | 0.82 | — | — | |
| SCHEMBL28873362 | 0.82 | — | — | |
| SCHEMBL4945925 | 0.82 | — | — | |
| SCHEMBL10946571 | 0.82 | — | — | |
| SCHEMBL9095436 | 0.82 | — | — | |
| SCHEMBL5998310 | 0.82 | — | — | |
| SCHEMBL15666809 | 0.82 | — | — | |
| Zinc Ion SCHEMBL28793916 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008137788-A1 | GAS SENSOR COMPRISING FILLED CARBON NANOTUBE | YAZAKI CORPORATION (JP) | 2008-11-13 | — | — | WO | disclosed |