⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL865491 | 0.79 | TSHR (0.42) | — | |
| SCHEMBL8120846 | 0.79 | — | — | |
| SCHEMBL22207497 | 0.78 | — | — | |
| SCHEMBL127775 | 0.77 | — | — | |
| SCHEMBL10474467 | 0.75 | — | — | |
| SCHEMBL865384 | 0.73 | — | — | |
| SCHEMBL4731212 | 0.73 | ALOX15 (0.46) | — | |
| SCHEMBL128295 | 0.73 | — | — | |
| SCHEMBL10431807 | 0.73 | — | — | |
| SCHEMBL22207173 | 0.73 | ALDH1A1 (0.50) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1446375-B1 | DIHALOGENPROPENE COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF, AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AS PEST CONTROL AGENTS | BAYER CROPSCIENCE SA (FR) | 2008-05-14 | — | — | EP | disclosed |
| US-6949551-B2 | Dihalopropene compounds, processes for their preparation, compositions comprising them and their use as pesticides | BAYER CROPSCIENCE S.A. (FR) | 2005-09-27 | — | — | US | disclosed |
| EP-1446375-A1 | DIHALOGENPROPENE COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF, AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AS PEST CONTROL AGENTS | Bayer CropScience S.A. (FR) | 2004-08-18 | — | — | EP | disclosed |
| US-20040029886-A1 | Dihalopropene compounds, processes for their preparation, compositions comprising them and their use as pesticides | MERIAL, INC. | 2004-02-12 | — | — | US | disclosed |
| WO-2003042147-A1 | DIHALOGENPROPENE COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF, AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AS PEST CONTROL AGENTS | BAYER CROPSCIENCE S.A. (FR) | 2003-05-22 | — | — | WO | disclosed |