⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18923 | 0.67 | — | — | |
| Fluoride SCHEMBL27787569 | 0.64 | — | — | |
| SCHEMBL10792128 | 0.64 | — | — | |
| SCHEMBL10902354 | 0.64 | — | — | |
| Acrylonitrile SCHEMBL10992814 | 0.62 | — | — | |
| SCHEMBL8965710 | 0.62 | — | — | |
| SCHEMBL594157 | 0.62 | — | — | |
| SCHEMBL12064473 | 0.62 | — | — | |
| Cyanamide SCHEMBL27825081 | 0.61 | — | — | |
| SCHEMBL789667 | 0.61 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8748343-B2 | Herbicide/safener combintions | BAYER CROPSCIENCE AG (DE) | 2014-06-10 | — | — | US | disclosed |
| US-20120322657-A1 | HERBICIDE/SAFENER COMBINTIONS | ZIEMER FRANK (DE) | 2012-12-20 | — | — | US | disclosed |
| EP-1130965-B2 | COMBINATIONS OF HERBICIDES AND SAFENERS | BAYER CROPSCIENCE AG (DE) | 2012-04-04 | — | — | EP | disclosed |
| CN-101671270-A | Method for synthesizing cyanoacetylene derivatives | HANGZHOU ALLSINO CHEMICALS CO | 2010-03-17 | — | — | CN | disclosed |
| US-20060030485-A1 | Herbicide/safener combinations | AVENTIS CROPSCIENCE GMBH | 2006-02-09 | — | — | US | disclosed |
| CN-1195414-C | Combinations of herbicides and safeners | AVENTIS CROPSCIENCE GMBH (DE) | 2005-04-06 | — | — | CN | disclosed |
| EP-1130965-B1 | COMBINATIONS OF HERBICIDES AND SAFENERS | BAYER CROPSCIENCE GMBH (DE) | 2003-10-29 | — | — | EP | disclosed |
| US-6613717-B1 | Phosphoric benzoyl derivatives and their use as herbicides | BASF AKTIENGESELLSCHAFT (DE) | 2003-09-02 | — | — | US | disclosed |
| EP-1173449-A1 | PHOSPHORIC BENZOYL DERIVATIVES AND THEIR USE AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2002-01-23 | — | — | EP | disclosed |
| CN-1326317-A | Combinations of herbicides and safeners | AVENTIS CROPSCIENCE GMBH (DE) | 2001-12-12 | — | — | CN | disclosed |
| EP-1130965-A1 | COMBINATIONS OF HERBICIDES AND SAFENERS | Aventis CropScience GmbH (DE) | 2001-09-12 | — | — | EP | disclosed |
| WO-2000064912-A1 | PHOSPHORIC BENZOYL DERIVATIVES AND THEIR USE AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2000-11-02 | — | — | WO | disclosed |
| WO-2000030447-A1 | COMBINATIONS OF HERBICIDES AND SAFENERS | AVENTIS CROPSCIENCE GMBH (DE) | 2000-06-02 | — | — | WO | disclosed |