⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12446708 | 1.00 | — | — | |
| SCHEMBL12446709 | 1.00 | — | — | |
| SCHEMBL12963048 | 0.92 | — | — | |
| SCHEMBL29634293 | 0.92 | — | — | |
| SCHEMBL12963049 | 0.92 | — | — | |
| SCHEMBL12963017 | 0.92 | — | — | |
| SCHEMBL12446715 | 0.91 | — | — | |
| SCHEMBL12446700 | 0.91 | — | — | |
| SCHEMBL12446712 | 0.91 | — | — | |
| SCHEMBL12887663 | 0.90 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20110166109-A1 | Synergistic Active Compound Combinations Comprising Phenyltriazoles | BAYER CROPSCIENCE AG (DE) | 2011-07-07 | — | — | US | disclosed |
| US-20110053996-A1 | Use of phenyltriazoles for controlling insects and spider mites by watering, droplet application or dip application or by treating seed | BAYER CROPSCIENCE AG (DE) | 2011-03-03 | — | — | US | disclosed |