⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14401477 | 0.81 | — | — | |
| SCHEMBL14401459 | 0.73 | — | — | |
| SCHEMBL14218474 | 0.70 | — | — | |
| SCHEMBL14401461 | 0.58 | — | — | |
| SCHEMBL14401473 | 0.58 | — | — | |
| SCHEMBL14401460 | 0.58 | — | — | |
| SCHEMBL17633949 | 0.56 | ESR2 (0.36) | — | |
| SCHEMBL855769 | 0.55 | — | — | |
| SCHEMBL7708482 | 0.55 | ESR2 (0.35) | — | |
| SCHEMBL22019179 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007110801-A2 | COMPOSITIONS AND METHODS TO ADD VALUE TO PLANT PORDUCTS, INCREASING THE COMMERCIAL QUALITY, RESISTANCE TO EXTERNAL FACTORS AND POLYPHENOL CONTENT THEREOF | LESCHOT SANHUEZA ANDRES ANTONI (CL) | 2007-10-04 | — | — | WO | disclosed |