⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31469727 | 1.00 | — | — | |
| SCHEMBL4539095 | 0.87 | — | — | |
| SCHEMBL1419791 | 0.87 | — | — | |
| SCHEMBL4527142 | 0.87 | — | — | |
| SCHEMBL25301997 | 0.75 | — | — | |
| SCHEMBL11585279 | 0.75 | — | — | |
| Methane SCHEMBL10481672 | 0.75 | — | — | |
| SCHEMBL11423607 | 0.75 | — | — | |
| SCHEMBL22260980 | 0.75 | — | — | |
| SCHEMBL25339 | 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-119492066-A | Solar-assisted carbon dioxide circulation heating system | 北京大学鄂尔多斯能源研究院 | 2025-02-21 | — | — | CN | disclosed |