⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4629985 | 0.69 | CYP1A2 (0.41) | — | |
| SCHEMBL1997949 | 0.68 | — | — | |
| SCHEMBL1232300 | 0.64 | HRH3 (0.42) | — | |
| SCHEMBL2454326 | 0.63 | — | — | |
| SCHEMBL2091617 | 0.63 | TSHR (0.30) | — | |
| SCHEMBL6687128 | 0.63 | GAA (0.46) | — | |
| SCHEMBL6320373 | 0.60 | ALDH1A1 (0.39) | — | |
| SCHEMBL11038622 | 0.58 | TDP1 (0.34) | — | |
| SCHEMBL2576444 | 0.58 | — | — | |
| SCHEMBL181391 | 0.58 | CYP1A2 (0.40) | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2802569-B1 | TETRAZOL-5-YL- UND TRIAZOL-5-YL-ARYL COMPOUNDS AND USE THEREOF AS HERBICIDES | BAYER IP GMBH (DE) | 2016-01-06 | — | — | EP | claimed |
| US-9107414-B2 | Tetrazol-5-yl- and triazol-5-yl-aryl compounds and use thereof as herbicides | BAYER CROPSCIENCE AG (DE) | 2015-08-18 | — | — | US | claimed |
| US-20140342906-A1 | TETRAZOL-5-YL- AND TRIAZOL-5-YL-ARYL COMPOUNDS AND USE THEREOF AS HERBICIDES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2014-11-20 | — | — | US | claimed |
| US-9107414-B2 | Tetrazol-5-yl- and triazol-5-yl-aryl compounds and use thereof as herbicides | BAYER CROPSCIENCE AG (DE) | 2015-08-18 | — | — | US | disclosed |
| US-9107414-B2 | Tetrazol-5-yl- and triazol-5-yl-aryl compounds and use thereof as herbicides | BAYER CROPSCIENCE AG (DE) | 2015-08-18 | — | — | US | disclosed |
| US-9107414-B2 | Tetrazol-5-yl- and triazol-5-yl-aryl compounds and use thereof as herbicides | BAYER CROPSCIENCE AG (DE) | 2015-08-18 | — | — | US | disclosed |
| WO-2015052178-A1 | 1,2,5-OXADIAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2015-04-16 | — | — | WO | disclosed |
| WO-2015052173-A1 | TETRAZOLE AND TRIAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2015-04-16 | — | — | WO | disclosed |
| US-20140342906-A1 | TETRAZOL-5-YL- AND TRIAZOL-5-YL-ARYL COMPOUNDS AND USE THEREOF AS HERBICIDES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2014-11-20 | — | — | US | disclosed |
| US-20140342906-A1 | TETRAZOL-5-YL- AND TRIAZOL-5-YL-ARYL COMPOUNDS AND USE THEREOF AS HERBICIDES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2014-11-20 | — | — | US | disclosed |
| EP-2802569-A1 | TETRAZOL-5-YL- AND TRIAZOL-5-YL-ARYL COMPOUNDS AND USE THEREOF AS HERBICIDES | Bayer Intellectual Property GmbH (DE) | 2014-11-19 | — | — | EP | disclosed |
| CN-104024234-A | Tetrazol-5-yl- and triazol-5-yl-aryl compounds and use thereof as herbicides | BAYER IP GMBH | 2014-09-03 | — | — | CN | disclosed |
| CN-104024234-A | Tetrazol-5-yl- and triazol-5-yl-aryl compounds and use thereof as herbicides | BAYER IP GMBH | 2014-09-03 | — | — | CN | disclosed |
| WO-2013104705-A1 | TETRAZOL-5-YL- AND TRIAZOL-5-YL-ARYL COMPOUNDS AND USE THEREOF AS HERBICIDES | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2013-07-18 | — | — | WO | disclosed |