⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2592934 | 1.00 | — | — | |
| SCHEMBL2580950 | 1.00 | — | — | |
| SCHEMBL27927372 | 0.82 | — | — | |
| SCHEMBL27779238 | 0.82 | — | — | |
| SCHEMBL27729624 | 0.82 | — | — | |
| SCHEMBL28062676 | 0.82 | — | — | |
| SCHEMBL2582071 | 0.82 | — | — | |
| SCHEMBL8902862 | 0.82 | — | — | |
| Water SCHEMBL29004128 | 0.82 | — | — | |
| SCHEMBL28692751 | 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 |
|---|---|---|---|---|---|---|---|
| CN-117029302-A | Integrated coaxial pulse tube refrigerator | 中国科学院上海技术物理研究所 | 2023-11-10 | — | — | CN | disclosed |