⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19489555 | 0.77 | CHRM1 (0.42) | — | |
| SCHEMBL10880586 | 0.75 | — | — | |
| SCHEMBL10883231 | 0.75 | — | — | |
| SCHEMBL8649653 | 0.73 | — | — | |
| SCHEMBL8973022 | 0.73 | — | — | |
| SCHEMBL29980156 | 0.71 | TSHR (0.32) | — | |
| SCHEMBL15254856 | 0.67 | CPA1 (0.36) | — | |
| SCHEMBL29138738 | 0.67 | — | — | |
| SCHEMBL3253097 | 0.67 | — | — | |
| SCHEMBL3253096 | 0.67 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2575451-A1 | COMPOUNDS, METHODS, AND DEVICES FOR DETECTING AND/OR TREATING INSECT INFESTATION | Bayer Cropscience LP (US) | 2013-04-10 | — | — | EP | claimed |
| WO-2011149901-A1 | COMPOUNDS, METHODS, AND DEVICES FOR DETECTING AND/OR TREATING INSECT INFESTATION | BAYER CROPSCIENCE LP (US) | 2011-12-01 | — | — | WO | claimed |
| EP-2575443-A1 | IDENTIFICATION OF INSECT ATTRACTANT, ARRESTING, AND/OR AGGREGATION COMPOUNDS AND METHODS THEREOF | Bayer Cropscience LP (US) | 2013-04-10 | — | — | EP | disclosed |
| EP-2575451-A1 | COMPOUNDS, METHODS, AND DEVICES FOR DETECTING AND/OR TREATING INSECT INFESTATION | Bayer Cropscience LP (US) | 2013-04-10 | — | — | EP | disclosed |
| US-20110293553-A1 | IDENTIFICATION OF INSECT ATTRACTANT, ARRESTING, AND/OR AGGREGATION COMPOUNDS AND METHODS THEREOF | UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION | 2011-12-01 | — | — | US | disclosed |
| WO-2011149899-A1 | IDENTIFICATION OF INSECT ATTRACTANT, ARRESTING, AND/OR AGGREGATION COMPOUNDS AND METHODS THEREOF | BAYER CROPSCIENCE LP (US) | 2011-12-01 | — | — | WO | disclosed |
| WO-2011149901-A1 | COMPOUNDS, METHODS, AND DEVICES FOR DETECTING AND/OR TREATING INSECT INFESTATION | BAYER CROPSCIENCE LP (US) | 2011-12-01 | — | — | WO | disclosed |