⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3774381 | 0.86 | — | — | |
| SCHEMBL24620217 | 0.82 | ALDH1A1 (0.30) | — | |
| SCHEMBL20329543 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL25353752 | 0.72 | — | — | |
| SCHEMBL75984 | 0.72 | — | — | |
| SCHEMBL1139426 | 0.72 | — | — | |
| SCHEMBL1153637 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL56064 | 0.69 | — | — | |
| SCHEMBL23311387 | 0.69 | ALDH1A1 (0.46) | — | |
| SCHEMBL20987612 | 0.69 | ALDH1A1 (0.46) | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010097374-A1 | COMPOUNDS FOR USE AS BRADYKININ B1 ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-09-02 | — | — | WO | disclosed |
| EP-0944633-B1 | SUBSTITUTED PHENYLKETOENOLS AND THEIR USE AS PESTICIDES AND HERBICIDES | BAYER CROPSCIENCE AG (DE) | 2007-10-10 | — | — | EP | disclosed |
| US-20060160847-A1 | 2,4-Dihalogen-6-(c2-c3alkyl)-phenyl substituted tetramic acid derivatives | BAYER CROPSCIENCE AG (DE) | 2006-07-20 | — | — | US | disclosed |
| EP-1587786-A1 | 2.4-DIHALOGEN-6-(C sb 2 /sb -C sb 3 /sb -ALKYL)-PHENYL SUBSTITUTED TETRAMIC ACID DERIVATIVES | Bayer CropScience Aktiengesellschaft (DE) | 2005-10-26 | — | — | EP | disclosed |
| WO-2004065366-A1 | 2.4-DIHALOGEN-6-(C2-C3-ALKYL)-PHENYL SUBSTITUTED TETRAMIC ACID DERIVATIVES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2004-08-05 | — | — | WO | disclosed |
| CN-1130366-C | Substituted phenylketoenols and their use as pesticides and herbicides | BAYER AG (DE) | 2003-12-10 | — | — | CN | disclosed |
| US-6630594-B2 | Spiro-pyran compounds; use as pesticides and herbicides | BAYER AKTIENGESELLSCHAFT (DE) | 2003-10-07 | — | — | US | disclosed |
| US-20020161034-A1 | Methods of making substituted phenylketoenols | HAGEMANN HERMANN (DE) | 2002-10-31 | — | — | US | disclosed |
| US-20020072617-A1 | Novel substituted phenylketoenols | HAGEMANN HERMANN (DE) | 2002-06-13 | — | — | US | disclosed |
| US-6391912-B1 | PESTICIDES, HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2002-05-21 | — | — | US | disclosed |
| US-6288102-B1 | Substituted phenylketoenols and their use as pesticides and herbicides | BAYER AKTIENGESELLSCHAFT (DE) | 2001-09-11 | — | — | US | disclosed |
| CN-1240449-A | Substituted phenylketoenols and their use as pesticides and herbicides | BAYER AG (DE) | 2000-01-05 | — | — | CN | disclosed |