⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL28235751 | 0.74 | PDE10A (0.41) | — | |
| SCHEMBL57064 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL28073257 | 0.70 | PDE10A (0.42) | — | |
| Hydrochloric Acid SCHEMBL29730080 | 0.70 | PDE10A (0.42) | — | |
| Fluoride SCHEMBL27905674 | 0.70 | POLB (0.45) | — | |
| Ammonia Solution, Strong SCHEMBL9197440 | 0.70 | PDE10A (0.42) | — | |
| Hydrochloric Acid SCHEMBL17225086 | 0.70 | PDE10A (0.42) | — | |
| SCHEMBL449344 | 0.67 | — | — | |
| SCHEMBL29274106 | 0.67 | HSPB1 (0.37) | — | |
| SCHEMBL12314702 | 0.67 | SMN1; SMN2 (0.42) | — |
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-2375898-B1 | NOVEL HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2015-09-16 | — | — | EP | claimed |
| EP-2997824-A1 | NOVEL HERBICIDES | Syngenta Participations AG. (CH) | 2016-03-23 | — | — | EP | disclosed |
| EP-2375898-B1 | NOVEL HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2015-09-16 | — | — | EP | disclosed |
| CN-104193693-A | NOVEL HERBICIDES | SYNGENTA LTD | 2014-12-10 | — | — | CN | disclosed |
| US-8889595-B2 | Herbicides | SYNGENTA PARTICIPATIONS AG (CH) | 2014-11-18 | — | — | US | disclosed |
| US-20120291159-A1 | Azoline Compounds for Combating Invertebrate Pests | BASF SE (DE) | 2012-11-15 | — | — | US | disclosed |
| US-20120065064-A1 | NOVEL HERBICIDES | SYNGENTA CROP PROTECTION LLC (US) | 2012-03-15 | — | — | US | disclosed |
| WO-2011073444-A2 | AZOLINE COMPOUNDS FOR COMBATING INVERTEBRATE PESTS | BASF SE (DE) | 2011-06-23 | — | — | WO | disclosed |