⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28722652 | 0.96 | — | — | |
| Lithium Ion SCHEMBL28980084 | 0.96 | — | — | |
| SCHEMBL28443852 | 0.96 | — | — | |
| SCHEMBL28913949 | 0.96 | — | — | |
| SCHEMBL28335017 | 0.96 | — | — | |
| SCHEMBL3194106 | 0.96 | — | — | |
| Potassium Ion SCHEMBL28541503 | 0.96 | — | — | |
| SCHEMBL6807739 | 0.77 | — | — | |
| Ammonia Solution, Strong SCHEMBL28980091 | 0.76 | — | — | |
| SCHEMBL15760480 | 0.71 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116162433-A | Heat-conducting flame-retardant double-component polyurethane structural adhesive and preparation method thereof | 同济大学 | 2023-05-26 | — | — | CN | claimed |
| CN-116162433-A | Heat-conducting flame-retardant double-component polyurethane structural adhesive and preparation method thereof | 同济大学 | 2023-05-26 | — | — | CN | disclosed |