⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28305143 | 0.81 | — | — | |
| SCHEMBL27289156 | 0.79 | — | — | |
| SCHEMBL27837877 | 0.79 | — | — | |
| SCHEMBL27361663 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL28058596 | 0.79 | — | — | |
| SCHEMBL28826898 | 0.75 | — | — | |
| SCHEMBL28058453 | 0.75 | — | — | |
| SCHEMBL27459564 | 0.74 | — | — | |
| SCHEMBL27473060 | 0.72 | — | — | |
| SCHEMBL27938865 | 0.71 | — | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110023302-A | 2,4, 5-trisubstituted 1,2, 4-triazolones as DHODH inhibitors | 拜耳股份有限公司 | 2019-07-16 | — | — | CN | disclosed |
| CN-105473558-B | Aromatic yl sulfide derivative and aryl oxysulfide derivative as acaricide and insecticide | 拜耳作物科学股份公司 | 2019-04-19 | — | — | CN | disclosed |
| CN-102573478-A | 1- (pyridin-3-yl) -pyrazoles and 1- (pyrimidin-5-yl) -pyrazoles as pesticides | BAYER CROPSCIENCE AG | 2012-07-11 | — | — | CN | disclosed |
| CN-102171190-A | Insecticidal benzenedicarboxamide derivative | BAYER CROPSCIENCE AG | 2011-08-31 | — | — | CN | disclosed |
| CN-1597672-A | Substituierte benzoylcyclohexandione | BAYER AG (DE) | 2005-03-23 | — | — | CN | disclosed |
| CN-1177835-C | Substituted Benzoylcyclohexanediones | — | 2004-12-01 | — | — | CN | disclosed |
| CN-1174961-C | Intermediate for preparing triazolinone and preparing method thereof | — | 2004-11-10 | — | — | CN | disclosed |
| CN-1149213-C | Substituted benzoylisoxazoles and the use thereof as herbicides | — | 2004-05-12 | — | — | CN | disclosed |
| CN-1113875-C | Substituted aromatic thiocarboxylic acid amides and their use as herbicides | BAYER AG (DE) | 2003-07-09 | — | — | CN | disclosed |
| CN-1358176-A | Method for producing 2-heterocyclyl methyl benzoic acid derivatives | BAYER AG (DE) | 2002-07-10 | — | — | CN | disclosed |
| CN-1068877-C | Process for preparing triazolinones and novel intermediates | BAYER AG (DE) | 2001-07-25 | — | — | CN | disclosed |
| CN-1281848-A | Intermediate for preparing triazolinone and preparing method thereof | BAYER AG (DE) | 2001-01-31 | — | — | CN | disclosed |
| CN-1255126-A | Heterocyclically substituted aromatic amino compounds with herbicidal effect | BAYER AG (DE) | 2000-05-31 | — | — | CN | disclosed |
| CN-1038129-C | Substituted triazolinones | BAYER AG (DE) | 1998-04-22 | — | — | CN | disclosed |
| CN-1036994-C | Substituted triazolinones | BAYER AG (DE) | 1998-01-14 | — | — | CN | disclosed |
| CN-1136558-A | Process for preparing triazolinones and novel intermediates | BAYER AG (DE) | 1996-11-27 | — | — | CN | disclosed |
| CN-1091738-A | The Triazolinones that replaces | BAYER AG (DE) | 1994-09-07 | — | — | CN | disclosed |
| CN-1090847-A | The Triazolinones that replaces | BAYER AG (DE) | 1994-08-17 | — | — | CN | disclosed |