⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL180757 | 0.89 | — | — | |
| SCHEMBL4301414 | 0.80 | — | — | |
| SCHEMBL7615128 | 0.80 | — | — | |
| SCHEMBL15366348 | 0.80 | — | — | |
| Magnesium SCHEMBL1449769 | 0.80 | — | — | |
| SCHEMBL11659799 | 0.80 | — | — | |
| SCHEMBL5897645 | 0.80 | — | — | |
| SCHEMBL10924797 | 0.80 | — | — | |
| SCHEMBL2723952 | 0.80 | — | — | |
| SCHEMBL14151417 | 0.80 | — | — |
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-2003029502-A2 | GETTER ALLOYS FOR THE SORPTION OF HYDROGEN AT HIGH TEMPERATURES | SAES GETTERS S.P.A. (IT) | 2003-04-10 | — | — | WO | disclosed |