⚠ 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 | |
|---|---|---|---|---|
| Formic Acid Methyl Ester SCHEMBL27912049 | 0.84 | PKM (0.38) | — | |
| SCHEMBL130382 | 0.80 | — | — | |
| SCHEMBL320817 | 0.80 | — | — | |
| SCHEMBL17033056 | 0.80 | MGAM (0.47) | — | |
| SCHEMBL10595962 | 0.76 | HTR2A (0.42) | — | |
| SCHEMBL11125501 | 0.75 | SLC6A2 (0.45) | — | |
| SCHEMBL19335822 | 0.75 | TAAR1 (0.43) | — | |
| SCHEMBL28794353 | 0.74 | ACHE (0.55) | — | |
| SCHEMBL24894404 | 0.73 | ALDH1A1 (0.41) | — | |
| SCHEMBL16934069 | 0.72 | ACHE (0.46) | — |
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 483 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110876916-B | 1000L photocatalytic reaction kettle engineering amplifying and fluorobenzyl and fluorobenzene producing photocatalytic reaction kettle and method | 浙江大洋生物科技集团股份有限公司 | 2024-07-26 | — | — | CN | claimed |
| EP-4273147-A1 | SUBSTITUTED SPIROLACTAMS, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES | Bayer Aktiengesellschaft (DE) | 2023-11-08 | — | — | EP | claimed |
| US-20230131260-A1 | SUBSTITUTED THIOPHENYL URACILS, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS | SYNGENTA CROP PROTECTION AG (CH) | 2023-04-27 | — | — | US | claimed |
| US-20220396533-A1 | METHOD FOR PREPARING DEUTERATED ORGANIC COMPOUNDS | ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) | 2022-12-15 | — | — | US | claimed |
| CN-115403435-A | Process for preparing deuterated organic compounds | 罗门哈斯电子材料韩国有限公司 | 2022-11-29 | — | — | CN | claimed |
| US-11274083-B2 | Substituted thiophenyl uracils, salts thereof and the use thereof as herbicidal agents | SYNGENTA CROP PROTECTION AG (CH) | 2022-03-15 | — | — | US | claimed |
| EP-3728237-B1 | SUBSTITUTED THIOPHENYLURACILS , THEIR SALTS AND USE OF SAID COMPOUNDS AS HERBICIDAL AGENTS | SYNGENTA CROP PROTECTION AG (CH) | 2022-02-09 | — | — | EP | claimed |
| EP-3728235-B1 | SUBSTITUTED THIOPHENYLURACILS , THEIR SALTS AND USE OF SAID COMPOUNDS AS HERBICIDAL AGENTS | SYNGENTA CROP PROTECTION AG (CH) | 2022-02-09 | — | — | EP | claimed |
| US-20210087151-A1 | SUBSTITUTED THIOPHENYL URACILS, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS | SYNGENTA CROP PROTECTION AG (CH) | 2021-03-25 | — | — | US | claimed |
| US-20200390100-A1 | SUBSTITUTED N-HETEROCYCLYL- AND N-HETEROARYL-TETRAHYDROPYRIMIDINONES AND THE SALTS THEREOF, AND THE USE OF SAME AS HERBICIDAL ACTIVE SUBSTANCES | BAYER AG (DE) | 2020-12-17 | — | — | US | claimed |
| US-20200315174-A1 | SUBSTITUTED THIOPHENYL URACILS, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS | SYNGENTA CROP PROTECTION AG (CH) | 2020-10-08 | — | — | US | claimed |
| US-20200095241-A1 | SUBSTITUTED 1,2,4-THIADIAZOLYLPYRROLONES AND 1,2,4-THIADIAZOLYLHYDANTOINS AND SALTS THEREOF AND USE THEREOF AS HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2020-03-26 | — | — | US | claimed |
| US-20200079765-A1 | SUBSTITUTED HETEROARYL PYRROLONES AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES | BAYER AKTIENGESELLSCHAFT (DE) | 2020-03-12 | — | — | US | claimed |
| US-20190330192-A1 | SUBSTITUTED AZOLYLPYRROLONES AND AZOLYLHYDANTOINS AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES | BAYER AKTIENGESELLSCHAFT (DE) | 2019-10-31 | — | — | US | claimed |
| US-7998623-B2 | Electrolyte for lithium ion secondary battery and lithium ion secondary battery including the same | SAMSUNG SDI CO., LTD. (KR) | 2011-08-16 | — | — | US | claimed |
| US-20060078792-A1 | Electrolyte for lithium ion secondary battery and lithium ion secondary battery including the same | SAMSUNG SDI CO., LTD. (KR) | 2006-04-13 | — | — | US | claimed |
| EP-0653412-B1 | Process for preparing 4,5-difluorobenzaldehydes | BAYER AG (DE) | 1998-01-21 | — | — | EP | claimed |
| US-5489715-A | Process for preparing 4,5-difluorobenzaldehydes | BAYER AKTIENGESELLSCHAFT (DE) | 1996-02-06 | — | — | US | claimed |
| JP-5320079-A | — | — | None | — | — | JP | disclosed |
| EP-0061907-A1 | Secondary amines, their preparation, pharmaceutical compositions containing them and their use | BEECHAM GROUP PLC (GB) | 1982-10-06 | — | — | EP | disclosed |