⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20789205 | 0.59 | — | — | |
| SCHEMBL28108454 | 0.59 | — | — | |
| SCHEMBL467970 | 0.47 | — | — | |
| Thiourea SCHEMBL850383 | 0.43 | — | — | |
| Thiourea SCHEMBL1008 | 0.43 | — | — | |
| Dioxane SCHEMBL22721823 | 0.43 | TSHR (0.50) | — | |
| Adamantane SCHEMBL25171693 | 0.43 | TSHR (0.50) | — | |
| Hydrazine SCHEMBL3798832 | 0.43 | — | — | |
| SCHEMBL14675637 | 0.43 | TSHR (0.50) | — | |
| SCHEMBL23813060 | 0.43 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-104797564-B | The 3- phenyl-isoxazole oxazoline -5- thioamides of the 3- phenyl-isoxazoles oxazoline -5- formamides and 5- epoxides of weeding and antifungal 5- epoxides-substituted-substituted | 拜尔农作物科学股份公司 | 2018-05-04 | — | — | CN | claimed |
| CN-104797577-B | Weeding and the formamide of 3 heteroaryl isoxazoline 5 and the thioamides of 3 heteroaryl isoxazoline 5 of Fungicidally active | 拜尔农作物科学股份公司 | 2018-01-12 | — | — | CN | claimed |
| CN-104797577-A | Herbicidally and fungicidally active 3-heteroaryl-isoxazoline-5-carboxamides and 3-heteroaryl-isoxazoline-5-thioamides | BAYER CROPSCIENCE AG | 2015-07-22 | — | — | CN | claimed |
| CN-111164077-B | Herbicidal 3-phenyl-5-trifluoromethyl isoxazoline-5-carboxamides of cyclopentylcarboxylic acids and esters thereof | 拜耳公司 | 2023-12-19 | — | — | CN | disclosed |
| CN-111868042-B | Herbicidal 3-phenylisoxazoline-5-carboxamides of cyclopentylcarboxylic acid derivatives | 拜耳公司 | 2023-12-05 | — | — | CN | disclosed |
| CN-110799511-B | Herbicidal 3-phenylisoxazoline-5-carboxamides of tetrahydro-and dihydrofurancarboxamides | 拜耳公司 | 2023-09-01 | — | — | CN | disclosed |
| CN-110770232-B | Herbicidal 3-phenylisoxazoline-5-carboxamides of tetrahydro-and dihydrofuran carboxylic acids and esters | 拜耳公司 | 2023-08-15 | — | — | CN | disclosed |
| CN-111868042-A | Herbicidally active 3-phenylisoxazoline-5-carboxamides of cyclopentyl carboxylic acid derivatives | 拜耳公司 | 2020-10-30 | — | — | CN | disclosed |
| CN-111164077-A | Herbicidally active 3-phenyl-5-trifluoromethyl-isoxazoline-5-carboxamides of cyclopentylcarboxylic acids and esters thereof | 拜耳公司 | 2020-05-15 | — | — | CN | disclosed |
| CN-110799511-A | Herbicidally active 3-phenylisoxazoline-5-carboxamides of tetrahydro-and dihydrofurancarboxamides | 拜耳公司 | 2020-02-14 | — | — | CN | disclosed |
| CN-110770232-A | Herbicidally active 3-phenylisoxazoline-5-carboxamides of tetrahydro-and dihydrofurancarboxylic acids and esters | 拜耳公司 | 2020-02-07 | — | — | CN | disclosed |
| CN-104797564-B | The 3- phenyl-isoxazole oxazoline -5- thioamides of the 3- phenyl-isoxazoles oxazoline -5- formamides and 5- epoxides of weeding and antifungal 5- epoxides-substituted-substituted | 拜尔农作物科学股份公司 | 2018-05-04 | — | — | CN | disclosed |
| CN-104797577-B | Weeding and the formamide of 3 heteroaryl isoxazoline 5 and the thioamides of 3 heteroaryl isoxazoline 5 of Fungicidally active | 拜尔农作物科学股份公司 | 2018-01-12 | — | — | CN | disclosed |
| CN-104797577-A | Herbicidally and fungicidally active 3-heteroaryl-isoxazoline-5-carboxamides and 3-heteroaryl-isoxazoline-5-thioamides | BAYER CROPSCIENCE AG | 2015-07-22 | — | — | CN | disclosed |