SCHEMBL5533885

SCHEMBL5533885

CC(C)(C(=O)Cl)C(Cl)Cl

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL26696494 0.89 ALDH1A1 (0.35)
SCHEMBL7962611 0.75
SCHEMBL1158338 0.75
SCHEMBL28446213 0.73
SCHEMBL30299661 0.73
SCHEMBL1127637 0.73
SCHEMBL8362573 0.73
Hydrochloric Acid SCHEMBL10565965 0.73 TSHR (0.40)
SCHEMBL11879747 0.73
SCHEMBL29112989 0.71

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 61 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112250559-B Recycling process of chloro pivaloyl chloride raffinate 王泽萱 2024-05-03 CN claimed
CN-112250559-A Process for recycling chloro pivaloyl chloride residual liquid 刘光辉 2021-01-22 CN claimed
CN-119487024-A Herbicidal compounds 先正达农作物保护股份公司 2025-02-18 CN disclosed
CN-119403791-A Isoxazolidine derivatives as herbicidal compounds 先正达农作物保护股份公司 2025-02-07 CN disclosed
CN-119255989-A Herbicidal compounds 先正达农作物保护股份公司 2025-01-03 CN disclosed
CN-112250559-B Recycling process of chloro pivaloyl chloride raffinate 王泽萱 2024-05-03 CN disclosed
WO-2023227737-A9 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2024-03-07 WO disclosed
WO-2023247293-A1 ISOXALIDINE DERIVATIVES AS HERICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-12-28 WO disclosed
WO-2023247293-A1 ISOXALIDINE DERIVATIVES AS HERICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-12-28 WO disclosed
WO-2023247301-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-12-28 WO disclosed
WO-2023247301-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-12-28 WO disclosed
EP-0247472-A2 Process for the preparation of carboxylic acid derivatives BAYER AG (DE) 1987-12-02 EP disclosed
EP-0132734-B1 NEOPENTYL ISOCYANATES AND THEIR PREPARATION BAYER AG (DE) 1987-03-25 EP disclosed
US-4609648-A SYNERGISTS FOR ARTHROPODICIDES BAYER AKTIENGESELLSCHAFT (DE) 1986-09-02 US disclosed
EP-0132733-B1 FLUOROPIVALIC-ACID FLUORIDES AND PROCESS FOR PRODUCING THEM BAYER AG (DE) 1986-06-11 EP disclosed
US-4549994-A INTERMEDIATES FOR MAKING CARBAMATE INSECTICIDE SYNERGISTS BAYER AKTIENGESELLSCHAFT (DE) 1985-10-29 US disclosed
EP-0132729-A2 Halogenoalkylcarbamic-acid esters, their preparation and their use as pesticides BAYER AG (DE) 1985-02-13 EP disclosed
EP-0132733-A2 Fluoropivalic-acid fluorides and process for producing them BAYER AG (DE) 1985-02-13 EP disclosed
EP-0132734-A2 Neopentyl isocyanates and their preparation BAYER AG (DE) 1985-02-13 EP disclosed
US-4405357-A Herbicidal 3-isoxazolidinones and hydroxamic acids FMC CORPORATION (US) 1983-09-20 US disclosed