⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL55071 | 0.96 | — | — | |
| SCHEMBL408267 | 0.92 | — | — | |
| SCHEMBL8367460 | 0.92 | — | — | |
| Potassium SCHEMBL31507351 | 0.92 | — | — | |
| SCHEMBL22409381 | 0.77 | — | — | |
| SCHEMBL57548 | 0.67 | — | — | |
| SCHEMBL17474379 | 0.65 | — | — | |
| Methane SCHEMBL190372 | 0.65 | ALDH1A1 (0.50) | — | |
| Hydrochloric Acid SCHEMBL7215896 | 0.65 | — | — | |
| Ammonia Solution, Strong SCHEMBL3496228 | 0.65 | — | — |
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-20090220413-A1 | Catalyst For Methane Steam Reformation, Method Of Producing The Same, And Method Of Producing Hydrogen Using The Same | NEC CORPORATION (JP) | 2009-09-03 | — | — | US | disclosed |