⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL647389 | 0.70 | — | — | |
| SCHEMBL8851499 | 0.70 | — | — | |
| SCHEMBL1559045 | 0.67 | — | — | |
| SCHEMBL709691 | 0.64 | — | — | |
| SCHEMBL5174333 | 0.64 | — | — | |
| SCHEMBL2592799 | 0.64 | — | — | |
| SCHEMBL6485151 | 0.64 | — | — | |
| SCHEMBL133812 | 0.64 | — | — | |
| SCHEMBL1901707 | 0.64 | — | — | |
| SCHEMBL5705554 | 0.61 | — | — |
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-104292343-A | Polyamino starch and preparation method thereof | UNIV LUDONG | 2015-01-21 | — | — | CN | disclosed |
| EP-0270111-A1 | Pyrimidine derivatives and agricultural or horticultural fungicidal composition contaning the same | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 1988-06-08 | — | — | EP | disclosed |