⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6860790 | 0.72 | — | — | |
| SCHEMBL825523 | 0.70 | — | — | |
| SCHEMBL8962163 | 0.69 | — | — | |
| SCHEMBL28025306 | 0.67 | — | — | |
| Butanone SCHEMBL28634079 | 0.67 | ALDH1A1 (0.56) | — | |
| SCHEMBL16248435 | 0.65 | — | — | |
| SCHEMBL19275819 | 0.65 | — | — | |
| SCHEMBL732495 | 0.65 | — | — | |
| SCHEMBL20663223 | 0.65 | — | — | |
| Butane SCHEMBL3248202 | 0.63 | HDAC1 (0.39) | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3036232-A1 | HERBICIDAL COMPOUNDS | Syngenta Limited (GB) | 2016-06-29 | — | — | EP | claimed |
| WO-2015024853-A1 | HERBICIDAL COMPOUNDS | SYNGENTA LIMITED (GB) | 2015-02-26 | — | — | WO | claimed |
| US-11608323-B2 | Herbicidal compounds | SYNGENTA PARTICIPATIONS AG (CH) | 2023-03-21 | — | — | US | disclosed |
| EP-3054773-B1 | HERBICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2022-01-26 | — | — | EP | disclosed |
| US-20190112288-A1 | HERBICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2019-04-18 | — | — | US | disclosed |
| US-9936701-B2 | Herbicidal compounds | SYNGENTA LIMITED (GB) | 2018-04-10 | — | — | US | disclosed |
| EP-2993986-B1 | HERBICIDAL ISOXAZOLYL SUBSTITUTED PYRROLONE DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2018-01-10 | — | — | EP | disclosed |
| EP-3036232-B1 | HERBICIDAL COMPOUNDS | SYNGENTA LTD (GB) | 2017-06-07 | — | — | EP | disclosed |
| US-9487502-B2 | Chemical compounds | SYNGENTA LIMITED (GB) | 2016-11-08 | — | — | US | disclosed |
| US-20160264547-A1 | Herbicidal Compounds | SYNGENTA PARTICIPATIONS AG (CH) | 2016-09-15 | — | — | US | disclosed |
| US-20160251332-A1 | Herbicidal Compounds | SYNGENTA PARTICIPATIONS AG (CH) | 2016-09-01 | — | — | US | disclosed |
| EP-3054773-A1 | HERBICIDAL COMPOUNDS | Syngenta Participations AG (CH) | 2016-08-17 | — | — | EP | disclosed |
| US-20160200708-A1 | CHEMICAL COMPOUNDS | SYNGENTA LIMITED (GB) | 2016-07-14 | — | — | US | disclosed |
| EP-3036232-A1 | HERBICIDAL COMPOUNDS | Syngenta Limited (GB) | 2016-06-29 | — | — | EP | disclosed |
| EP-2993986-A1 | HERBICIDAL COMPOUNDS | Syngenta Participations AG (CH) | 2016-03-16 | — | — | EP | disclosed |
| US-20160066574-A1 | Herbicidal Compounds | SYNGENTA LIMITED (GB) | 2016-03-10 | — | — | US | disclosed |
| WO-2015052076-A1 | HERBICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2015-04-16 | — | — | WO | disclosed |
| WO-2015024853-A1 | HERBICIDAL COMPOUNDS | SYNGENTA LIMITED (GB) | 2015-02-26 | — | — | WO | disclosed |
| WO-2014180740-A1 | HERBICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2014-11-13 | — | — | WO | disclosed |