⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21758880 | 0.84 | — | — | |
| SCHEMBL8054687 | 0.78 | — | — | |
| SCHEMBL16315800 | 0.75 | — | — | |
| SCHEMBL22821841 | 0.75 | — | — | |
| SCHEMBL5960710 | 0.75 | — | — | |
| SCHEMBL5960713 | 0.75 | — | — | |
| SCHEMBL10290297 | 0.73 | — | — | |
| SCHEMBL21788161 | 0.73 | — | — | |
| SCHEMBL93739 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL8425290 | 0.73 | ALDH1A1 (0.37) | — |
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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3648606-A1 | NOVEL SUBSTITUTED ISOTHIAZOLOPYRIDONES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES AND/OR PLANT GROWTH REGULATORS | Bayer CropScience Aktiengesellschaft (DE) | 2020-05-13 | — | — | EP | disclosed |
| EP-3648605-A1 | NOVEL ISOTHIAZOLO-BASED BICYCLES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES AND/OR PLANT GROWTH REGULATORS | Bayer CropScience Aktiengesellschaft (DE) | 2020-05-13 | — | — | EP | disclosed |
| EP-3519405-A1 | 5-SUBSTITUTED IMIDAZOLYLMETHYLOXIRANE DERIVATIVES AS FUNGICIDES | Bayer CropScience Aktiengesellschaft (DE) | 2019-08-07 | — | — | EP | disclosed |
| EP-3519389-A1 | NOVEL 5-SUBSTITUTED IMIDAZOLYLMETHYL DERIVATIVES | Bayer CropScience Aktiengesellschaft (DE) | 2019-08-07 | — | — | EP | disclosed |
| EP-3519392-A1 | NOVEL 5-SUBSTITUTED IMIDAZOLE DERIVATIVES | Bayer CropScience Aktiengesellschaft (DE) | 2019-08-07 | — | — | EP | disclosed |
| WO-2019007793-A1 | NOVEL ISOTHIAZOLO-BASED BICYCLES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES AND/OR PLANT GROWTH REGULATORS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2019-01-10 | — | — | WO | disclosed |
| WO-2019007795-A1 | NOVEL SUBSTITUTED ISOTHIAZOLOPYRIDONES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES AND/OR PLANT GROWTH REGULATORS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2019-01-10 | — | — | WO | disclosed |
| WO-2018145921-A1 | COMPOSITION FOR CONTROLLING HARMFUL MICROORGANISMS COMPRISING 1 -(PHENOXY-PYRIDINYL)-2-(1,2,4-TRIAZOL-1 -YL)-ETHANOL DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2018-08-16 | — | — | WO | disclosed |
| WO-2018145933-A1 | TRIAZOLETHIONE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2018-08-16 | — | — | WO | disclosed |
| WO-2018145932-A1 | TRIAZOLE DERIVATIVES AND THEIR USE AS FUNGICIDES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2018-08-16 | — | — | WO | disclosed |
| WO-2014167009-A1 | NOVEL TRIAZOLE DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2014-10-16 | — | — | WO | disclosed |
| WO-2014167008-A1 | NOVEL TRIAZOLINTHIONE DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2014-10-16 | — | — | WO | disclosed |
| WO-2014095678-A1 | TETRAHYDRONAPHTHYL(THIO) CARBOXAMIDES | BAYER CROPSCIENCE AG (DE) | 2014-06-26 | — | — | WO | disclosed |
| WO-2013167549-A1 | PYRAZOLE INDANYL CARBOXAMIDES | BAYER CROPSCIENCE AG (DE) | 2013-11-14 | — | — | WO | disclosed |
| EP-1966147-A1 | CARBOXAMIDES FOR CONTROLLING MICRO-ORGANISMS IN PLANT AND MATERIAL PROTECTION | Bayer CropScience AG (DE) | 2008-09-10 | — | — | EP | disclosed |
| EP-1966148-A1 | CARBOXAMIDES | Bayer CropScience AG (DE) | 2008-09-10 | — | — | EP | disclosed |
| WO-2007068373-A1 | CARBOXAMIDES | BAYER CROPSCIENCE AG (DE) | 2007-06-21 | — | — | WO | disclosed |
| WO-2007068377-A1 | CARBOXAMIDES FOR CONTROLLING MICRO-ORGANISMS IN PLANT AND MATERIAL PROTECTION | BAYER CROPSCIENCE AG (DE) | 2007-06-21 | — | — | WO | disclosed |
| EP-1713789-A1 | 2-HALOFURYL/THIENYL-3-CARBOXAMIDES | Bayer CropScience Aktiengesellschaft (DE) | 2006-10-25 | — | — | EP | disclosed |
| WO-2005075452-A1 | 2-HALOFURYL/THIENYL-3-CARBOXAMIDES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2005-08-18 | — | — | WO | disclosed |