⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7058018 | 0.73 | FDPS (0.31) | — | |
| SCHEMBL2327638 | 0.71 | FDPS (0.31) | — | |
| SCHEMBL7863769 | 0.70 | FDPS (0.32) | — | |
| SCHEMBL2274348 | 0.69 | — | — | |
| SCHEMBL28224047 | 0.68 | FDPS (0.36) | — | |
| SCHEMBL9451842 | 0.68 | — | — | |
| SCHEMBL19622440 | 0.67 | — | — | |
| SCHEMBL11260448 | 0.63 | FDPS (0.31) | — | |
| SCHEMBL2272196 | 0.63 | — | — | |
| SCHEMBL529708 | 0.62 | FDPS (0.32) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0955806-B1 | BIOACTIVE COMPOUNDS | US AGRICULTURE (US) | 2003-05-14 | — | — | EP | disclosed |
| EP-0955806-A4 | BIOACTIVE COMPOUNDS | US AGRICULTURE (US) | 2000-05-31 | — | — | EP | disclosed |
| EP-0955806-A1 | BIOACTIVE COMPOUNDS | THE UNITED STATES OF AMERICA as represented by THE SECRETARY OF AGRICULTURE (US) | 1999-11-17 | — | — | EP | disclosed |
| US-5854178-A | Bioactive compounds | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1998-12-29 | — | — | US | disclosed |
| US-5710099-A | AMINO ETHERS, ENHANCING PLANT GROWTH, INSECT RESISTANCE, INCREASING TAXOL CONTENT IN YEWS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1998-01-20 | — | — | US | disclosed |
| WO-1997031529-A1 | BIOACTIVE COMPOUNDS | THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1997-09-04 | — | — | WO | disclosed |