⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11698540 | 0.97 | — | — | |
| SCHEMBL8846796 | 0.86 | — | — | |
| SCHEMBL8679447 | 0.85 | — | — | |
| SCHEMBL11752483 | 0.80 | — | — | |
| SCHEMBL11522240 | 0.79 | TSHR (0.41) | — | |
| SCHEMBL12889649 | 0.79 | NOS3 (0.30) | — | |
| SCHEMBL29281834 | 0.79 | — | — | |
| SCHEMBL7405800 | 0.77 | — | — | |
| SCHEMBL11380591 | 0.77 | — | — | |
| SCHEMBL11698546 | 0.75 | CYP3A4 (0.32) | — |
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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111825520-A | Preparation process of alpha, alpha' -tetrachloro-o-xylene | 西安思科赛实业有限公司 | 2020-10-27 | — | — | CN | claimed |
| US-4446327-A | PENTACHLORO-O-XYLENE, HYDROLYSIS, LEWIS ACID CATALYST | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) | 1984-05-01 | — | — | US | claimed |
| US-4056454-A | FROM O-XYLENE AND CHLORINE, CARBON TETRACHLORIDE SOLVENT | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DT) | 1977-11-01 | — | — | US | claimed |
| US-4039587-A | Method of preparing polynuclear, halogenated, aromatic benzyl ethers | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DT) | 1977-08-02 | — | — | US | claimed |
| JP-8127553-A | — | — | None | — | — | JP | disclosed |
| JP-63303947-A | — | — | None | — | — | JP | disclosed |
| CN-111825520-A | Preparation process of alpha, alpha' -tetrachloro-o-xylene | 西安思科赛实业有限公司 | 2020-10-27 | — | — | CN | disclosed |
| CN-111825520-A | Preparation process of alpha, alpha' -tetrachloro-o-xylene | 西安思科赛实业有限公司 | 2020-10-27 | — | — | CN | disclosed |
| EP-3045440-B1 | METHOD FOR THE PREPARATION OF TRICHLOROMETHYL-GROUP-SUBSTITUTED BENZENE | FININGS CO LTD (CN) | 2019-06-12 | — | — | EP | disclosed |
| US-9556090-B2 | Method for the preparation of trichloromethyl-group-substituted benzene | SHANGHAI FANGLUN NEW MATERIAL TECHNOLOGY CO., LTD. (CN) | 2017-01-31 | — | — | US | disclosed |
| EP-3045440-A1 | METHOD FOR THE PREPARATION OF TRICHLOROMETHYL-GROUP-SUBSTITUTED BENZENE | Shanghai Fanglun New Material Technology Co. Ltd. (CN) | 2016-07-20 | — | — | EP | disclosed |
| US-20160152533-A1 | METHOD FOR THE PREPARATION OF TRICHLOROMETHYL-GROUP-SUBSTITUTED BENZENE | Shanghai Fanglun New Marerial Technology Co., Ltd. (CN) | 2016-06-02 | — | — | US | disclosed |
| EP-0077853-A1 | Novel trifluoromethyl benzal chlorides and process for the preparation thereof | OCCIDENTAL CHEMICAL CORPORATION (US) | 1983-05-04 | — | — | EP | disclosed |
| US-4367348-A | Novel trifluoromethyl benzal chlorides and process for the preparation thereof | OCCIDENTAL CHEMICAL CORPORATION (US) | 1983-01-04 | — | — | US | disclosed |
| US-4328374-A | Process for the production of aromatic dialdehydes | MITSUBISHI GAS CHEMICAL CO., INC. (JP) | 1982-05-04 | — | — | US | disclosed |
| US-4059618-A | CROSSLINKING | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DT) | 1977-11-22 | — | — | US | disclosed |
| US-4056454-A | FROM O-XYLENE AND CHLORINE, CARBON TETRACHLORIDE SOLVENT | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DT) | 1977-11-01 | — | — | US | disclosed |
| US-4039587-A | Method of preparing polynuclear, halogenated, aromatic benzyl ethers | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DT) | 1977-08-02 | — | — | US | disclosed |
| US-4007220-A | HYDROLYSIS | GRUPPO LEPETIT S.P.A. (IT) | 1977-02-08 | — | — | US | disclosed |
| US-4000052-A | METHOD OF PREPARING METHYLCHLOROMETHYLTETRACHLOROBENZENES AND DI-(CHLOROMETHYL)-TETRACHLOROBENZENES | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DT) | 1976-12-28 | — | — | US | disclosed |