⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20529345 | 0.80 | — | — | |
| SCHEMBL1316835 | 0.78 | — | — | |
| SCHEMBL4445302 | 0.78 | — | — | |
| SCHEMBL146151 | 0.75 | — | — | |
| SCHEMBL14784771 | 0.75 | — | — | |
| SCHEMBL4243150 | 0.70 | — | — | |
| SCHEMBL8657560 | 0.69 | ALDH1A1 (0.39) | — | |
| SCHEMBL9386556 | 0.67 | — | — | |
| SCHEMBL4954229 | 0.67 | — | — | |
| SCHEMBL566109 | 0.67 | — | — |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080113994-A1 | Annelated Quinoline Derivatives As Pesticide | VELTEN ROBERT | 2008-05-15 | — | — | US | claimed |
| EP-1735317-A1 | ANNELATED QUINOLINE DERIVATIVES AS PESTICIDE | Bayer CropScience Aktiengesellschaft (DE) | 2006-12-27 | — | — | EP | claimed |
| US-20060148649-A1 | Substituted n-aryl nitrogen heterocycles | BAYER CROPSCIENCE GMBH PATENTS AND LICENSING (DE) | 2006-07-06 | — | — | US | claimed |
| EP-1599465-A1 | SUBSTITUTED N-ARYL NITROGEN HETEROCYCLES | Bayer CropScience AG (DE) | 2005-11-30 | — | — | EP | claimed |
| WO-2005097802-A1 | ANNELATED QUINOLINE DERIVATIVES AS PESTICIDE | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2005-10-20 | — | — | WO | claimed |
| WO-2004074274-A1 | SUBSTITUTED N-ARYL NITROGEN HETEROCYCLES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2004-09-02 | — | — | WO | claimed |
| US-20090099192-A1 | Substituted 1H-pyrrole-2,5-diones | BAYER CROPSCIENCE AG (DE) | 2009-04-16 | — | — | US | disclosed |
| US-20080113994-A1 | Annelated Quinoline Derivatives As Pesticide | VELTEN ROBERT | 2008-05-15 | — | — | US | disclosed |
| EP-1771068-A1 | SUBSTITUTED 1H-PYRROLE-2,5-DIONES | Bayer CropScience Aktiengesellschaft (DE) | 2007-04-11 | — | — | EP | disclosed |
| EP-1735317-A1 | ANNELATED QUINOLINE DERIVATIVES AS PESTICIDE | Bayer CropScience Aktiengesellschaft (DE) | 2006-12-27 | — | — | EP | disclosed |
| US-20060148649-A1 | Substituted n-aryl nitrogen heterocycles | BAYER CROPSCIENCE GMBH PATENTS AND LICENSING (DE) | 2006-07-06 | — | — | US | disclosed |
| WO-2006007998-A1 | SUBSTITUTED 1H-PYRROLE-2,5-DIONES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2006-01-26 | — | — | WO | disclosed |
| EP-1599465-A1 | SUBSTITUTED N-ARYL NITROGEN HETEROCYCLES | Bayer CropScience AG (DE) | 2005-11-30 | — | — | EP | disclosed |
| WO-2005097802-A1 | ANNELATED QUINOLINE DERIVATIVES AS PESTICIDE | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2005-10-20 | — | — | WO | disclosed |
| WO-2004074274-A1 | SUBSTITUTED N-ARYL NITROGEN HETEROCYCLES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2004-09-02 | — | — | WO | disclosed |
| US-5767286-A | REACTING A TETRAZOLINONE WITH A CARBAMOYL CHLORIDE IN THE PRESENCE OF 4-DIMETHYLAMINOPYRIDINE | NIHON BAYER AGROCHEM K. K. (JP) | 1998-06-16 | — | — | US | disclosed |
| EP-0646577-B1 | Process for the preparation of 1,4-disubstituted-5(4H)-tetrazolinones | BAYER AGROCHEM KK (JP) | 1998-06-03 | — | — | EP | disclosed |
| EP-0643049-B1 | A process for the preparation of 1-substituted-5(4H)-tetrazolinones | BAYER AGROCHEM KK (JP) | 1997-05-14 | — | — | EP | disclosed |
| US-5502204-A | REACTING WITH ETHYLENE OXIDE DERIVATIVE | NIHON BAYER AGROCHEM K.K. (JP) | 1996-03-26 | — | — | US | disclosed |
| EP-0646577-A1 | Process for the preparation of 1,4-disubstituted-5(4H)-tetrazolinones | NIHON BAYER AGROCHEM K.K. (JP) | 1995-04-05 | — | — | EP | disclosed |