⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28112932 | 0.87 | — | — | |
| SCHEMBL9219 | 0.87 | — | — | |
| SCHEMBL28418307 | 0.75 | — | — | |
| Water SCHEMBL18131 | 0.75 | — | — | |
| Phosphine SCHEMBL28859421 | 0.75 | — | — | |
| Water SCHEMBL23461835 | 0.75 | — | — | |
| Water SCHEMBL483059 | 0.75 | — | — | |
| SCHEMBL23040668 | 0.75 | — | — | |
| Ammonia Solution, Strong SCHEMBL22029282 | 0.75 | — | — | |
| SCHEMBL28536501 | 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-104896787-A | An adsorption refrigeration device driven by engine exhaust gas | UNIV SHANGHAI JIAOTONG | 2015-09-09 | — | — | CN | disclosed |