⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3289561 | 0.71 | — | — | |
| SCHEMBL21422238 | 0.71 | — | — | |
| SCHEMBL16371030 | 0.67 | ALDH1A1 (0.38) | — | |
| SCHEMBL14761347 | 0.64 | METAP2 (0.38) | — | |
| SCHEMBL38660365 | 0.63 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL19783978 | 0.63 | METAP2 (0.39) | — | |
| SCHEMBL11239424 | 0.63 | ADORA2B (0.40) | — | |
| SCHEMBL11251405 | 0.63 | CYP3A4 (0.43) | — | |
| SCHEMBL21407925 | 0.62 | KDM4E (0.54) | — | |
| SCHEMBL16371551 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3484877-B1 | BICYCLIC COMPOUNDS AS PEST CONTROLLERS | BAYER CROPSCIENCE AG (DE) | 2020-07-01 | — | — | EP | disclosed |
| WO-2018011111-A1 | BICYCLIC COMPOUNDS AS PEST CONTROL AGENTS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2018-01-18 | — | — | WO | disclosed |