⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10238220 | 0.91 | KDM4E (0.35) | — | |
| SCHEMBL10238223 | 0.90 | — | — | |
| SCHEMBL10238190 | 0.83 | ADAMTS5 (0.31) | — | |
| SCHEMBL10732134 | 0.74 | SLC6A3 (0.35) | — | |
| SCHEMBL11128277 | 0.74 | SLC6A3 (0.35) | — | |
| SCHEMBL13041565 | 0.72 | GLA (0.31) | — | |
| SCHEMBL15821591 | 0.72 | SLC6A3 (0.35) | — | |
| SCHEMBL15821588 | 0.72 | SLC6A3 (0.35) | — | |
| SCHEMBL10237978 | 0.71 | POLB (0.33) | — | |
| SCHEMBL10279571 | 0.71 | SLC6A3 (0.37) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2176222-B1 | NOVEL HERBICIDES | SYNGENTA LTD (GB) | 2014-11-05 | — | — | EP | disclosed |
| US-8541594-B2 | — | — | 2013-09-24 | — | — | US | disclosed |
| US-8541594-B2 | — | — | 2013-09-24 | — | — | US | disclosed |
| US-20120040826-A1 | NOVEL HERBICIDES | SYNGENTA LIMITED (GB) | 2012-02-16 | — | — | US | disclosed |
| US-20120040826-A1 | NOVEL HERBICIDES | SYNGENTA LIMITED (GB) | 2012-02-16 | — | — | US | disclosed |
| WO-2009015877-A1 | NOVEL HERBICIDES | SYNGENTA LIMITED (GB) | 2009-02-05 | — | — | WO | disclosed |