⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL1642052 | 0.96 | TSHR (0.57) | — | |
| Nitrogen SCHEMBL28826445 | 0.93 | TSHR (0.53) | — | |
| Ethylene SCHEMBL28314914 | 0.93 | TSHR (0.53) | — | |
| SCHEMBL147796 | 0.92 | — | — | |
| Bromide SCHEMBL30994910 | 0.89 | TSHR (0.47) | — | |
| SCHEMBL28097444 | 0.89 | TSHR (0.47) | — | |
| SCHEMBL13538918 | 0.87 | TSHR (0.47) | — | |
| SCHEMBL788179 | 0.85 | TSHR (0.44) | — | |
| SCHEMBL5424151 | 0.81 | ALDH1A1 (0.43) | — | |
| SCHEMBL27856299 | 0.81 | TSHR (0.39) | — |
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 1993 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119118787-A | Process method for separating impurity-containing dichlorotoluene isomer | 中盐常州化工股份有限公司 | 2024-12-13 | — | — | CN | claimed |
| CN-114988982-B | Method for synthesizing 3, 5-dichlorotoluene through isomerization | 江苏聚由新材料科技有限公司 | 2024-12-03 | — | — | CN | claimed |
| CN-118955242-A | Method for preparing m-dichlorobenzene and 3, 5-dichlorotoluene by one-pot method | 帕潘纳(北京)科技有限公司 | 2024-11-15 | — | — | CN | claimed |
| CN-118894759-A | Preparation method of 3, 5-dichlorotoluene | 帕潘纳(北京)科技有限公司 | 2024-11-05 | — | — | 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 |
| CN-114988982-A | Method for isomerizing and synthesizing 3, 5-dichlorotoluene | 江苏超跃化学有限公司 | 2022-09-02 | — | — | CN | claimed |
| CN-111548644-B | Synthetic method of phthalocyanine blue dye | 浙江瑞华化工有限公司 | 2022-08-26 | — | — | 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-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-6140342-A | CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITOR; USED TO ELEVATE CERTAIN PLASMA LIPID LEVELS, INCLUDING HIGH DENSITY LIPOPROTEIN-CHOLESTEROL AND TO LOWER CERTAIN OTHER PLASMA LIPID LEVELS, SUCH AS LDL-CHOLESTEROL AND TRIGLYCERIDES | PFIZER INC. (US) | 2000-10-31 | — | — | US | claimed |
| WO-2000017164-A1 | 4-CARBOXYAMINO-2-SUBSTITUTED-1,2,3,4-TETRAHYDROQUINOLINES AS CETP INHIBITORS | PFIZER PRODUCTS INC. (US) | 2000-03-30 | — | — | WO | claimed |
| EP-0987251-A1 | 4-carboxyamino-2-methyl-1,2,3,4-tetrahydroquinolines as CETP inhibitors | Pfizer Products Inc. (US) | 2000-03-22 | — | — | EP | claimed |
| EP-0246673-B1 | PROCESS FOR SEPARATING A CHLOROTOLUENE ISOMER | TORAY INDUSTRIES, INC. (JP) | 1991-09-11 | — | — | EP | claimed |
| EP-0125077-B1 | ADSORPTIVE SEPARATION PROCESS | TORAY INDUSTRIES, INC. (JP) | 1989-06-28 | — | — | EP | claimed |
| US-4774371-A | ISOMERIZATION OF DICHLOROTOLUENES | TORAY INDUSTRIES, INC. (JP) | 1988-09-27 | — | — | US | claimed |
| US-4748245-A | Process for making phenylthiopyrimidines | STAUFFER CHEMICAL COMPANY (US) | 1988-05-31 | — | — | US | claimed |
| EP-0246673-A1 | Process for separating a chlorotoluene isomer | TORAY INDUSTRIES, INC. (JP) | 1987-11-25 | — | — | EP | claimed |
| US-4537714-A | Process for the preparation of lower alkyl esters of N-L-α-aspartyl-L-phenylalanine and of new intermediates for their preparation | EPROVA AG FORSCHUNGSINSTITUT (CH) | 1985-08-27 | — | — | US | claimed |
| EP-0125077-A1 | Adsorptive separation process | TORAY INDUSTRIES, INC. (JP) | 1984-11-14 | — | — | EP | claimed |