⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6647596 | 0.88 | TAAR1 (0.47) | — | |
| Hydrochloric Acid SCHEMBL11539056 | 0.86 | TAAR1 (0.46) | — | |
| SCHEMBL17209490 | 0.77 | TAAR1 (0.43) | — | |
| SCHEMBL14903795 | 0.74 | TAAR1 (0.53) | — | |
| SCHEMBL13377607 | 0.69 | TAAR1 (0.38) | — | |
| SCHEMBL14914794 | 0.68 | — | — | |
| SCHEMBL14916238 | 0.68 | — | — | |
| SCHEMBL13117921 | 0.68 | TAAR1 (0.37) | — | |
| SCHEMBL10653698 | 0.68 | TAAR1 (0.37) | — | |
| SCHEMBL9414968 | 0.68 | PLAU (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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2060571-A1 | Insecticide iminoheterocycles | Bayer CropScience AG (DE) | 2009-05-20 | — | — | EP | disclosed |
| EP-2060571-A1 | Insecticide iminoheterocycles | Bayer CropScience AG (DE) | 2009-05-20 | — | — | EP | disclosed |
| WO-2009049798-A1 | IMINOHETEROCYCLES FOR INSECTICIDES | BAYER CROPSCIENCE AG (DE) | 2009-04-23 | — | — | WO | disclosed |
| WO-2009049798-A1 | IMINOHETEROCYCLES FOR INSECTICIDES | BAYER CROPSCIENCE AG (DE) | 2009-04-23 | — | — | WO | disclosed |
| EP-2014168-A1 | Insecticidal heterocyclic compounds | Bayer CropScience AG (DE) | 2009-01-14 | — | — | EP | disclosed |
| EP-2014168-A1 | Insecticidal heterocyclic compounds | Bayer CropScience AG (DE) | 2009-01-14 | — | — | EP | disclosed |
| WO-2008155031-A1 | HETEROCYCLIC COMPOUNDS FOR INSECTICIDES | BAYER CROPSCIENCE AG (DE) | 2008-12-24 | — | — | WO | disclosed |
| WO-2008155031-A1 | HETEROCYCLIC COMPOUNDS FOR INSECTICIDES | BAYER CROPSCIENCE AG (DE) | 2008-12-24 | — | — | WO | disclosed |