SCHEMBL189345

SCHEMBL189345

CCOC(=O)C(Br)CC

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
SCHEMBL1732696 1.00
SCHEMBL1732642 1.00
SCHEMBL36999 0.84 ZDHHC7 (0.47)
SCHEMBL1286734 0.84 ALDH1A1 (0.46)
SCHEMBL240521 0.84 ZDHHC7 (0.47)
SCHEMBL14016338 0.84 ALDH1A1 (0.46)
SCHEMBL9128077 0.82
SCHEMBL8616785 0.82
SCHEMBL123249 0.82
SCHEMBL20328792 0.81 ALDH1A1 (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 1725 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12522850-B2 Fluoroacetate dehalogenase mutant and application thereof Abiochem Biotechnology (Group) Co., Ltd. (CN) 2026-01-13 US claimed
CN-116338015-B Detection method of ethyl 4-bromobutyrate related substances 成都倍特药业股份有限公司 2025-05-16 CN claimed
CN-119431135-B Preparation method of 4- (4-hydroxymethyl-3-methoxyphenoxy) butyric acid 安徽昊帆生物有限公司 2025-04-08 CN claimed
CN-119431135-A Preparation method of 4- (4-hydroxymethyl-3-methoxyphenoxy) butyric acid 安徽昊帆生物有限公司 2025-02-14 CN claimed
CN-115959993-B Synthesis method of 2-aryl propionic acid compound 山东中医药大学 2025-01-07 CN claimed
CN-119264313-A Preparation method of biocompatible membrane for biosensor and glucose sensor 深圳津合生物有限公司 2025-01-07 CN claimed
CN-221965268-U Reaction kettle for synthesizing ethyl 2-bromobutyrate 昌邑市丰润精细化工有限公司 2024-11-08 CN claimed
WO-2024207751-A1 SYNTHESIS METHOD FOR TAIL-TYPE PHENYLALANINE PORPHYRIN DERIVATIVE AND USE OF TAIL-TYPE PHENYLALANINE PORPHYRIN DERIVATIVE 井冈山大学 2024-10-10 WO claimed
CN-221655845-U Scraper evaporator for preparing ethyl bromobutyrate 黄冈融锦化工股份有限公司 2024-09-06 CN claimed
US-12077511-B2 Organic amine salt of key intermediate of Elagolix sodium and preparation method thereof NANJING CHEMPION BIOTECHNOLOGY CO., LTD. (CN) 2024-09-03 US claimed
CN-1785949-A Calixarene kind lean uranium discharge prometor, its preparation method and use UNIV BEIJING NORMAL (CN) 2006-06-14 CN claimed
US-20060025516-A1 Tissue protecting spray-on copolymeric film composition POLY-MED, INC. 2006-02-02 US claimed
CN-1159344-C Method for preparing gradient copolymer 北京燕山石油化工公司研究院 2004-07-28 CN claimed
CN-1358770-A Method for preparing gradient copolymer BEIJING RES INST YANSHAN PETRO (CN) 2002-07-17 CN claimed
EP-1112261-B1 2-ETHYL-2,3-DIHYDROBENZOFURAN-CARBOXYLIC ACID ESTER DERIVATIVE, PREPARATION METHOD AND USE FOR PREPARING EFAROXAN DERIVATIVES PIERRE FABRE SANTE S A (FR) 2002-04-10 EP claimed
EP-0769487-B1 Process for preparing carboxyl groups containing alkyl aryl ethers BAYER AG (DE) 2000-01-26 EP claimed
US-5869735-A Process for the preparation of alkyl aryl ethers containing carboxyl groups BAYER AKTIENGESELLSCHAFT (DE) 1999-02-09 US claimed
EP-0107569-B1 6-AMINO-7-HYDROXY-4,5,6,7-TETRAHYDROIMIDAZO(4,5,1-J,K)(1)BENZAZEPIN-2(1H)-ONE DERIVATIVES, THEIR SALTS, THEIR PREPARATION, THEIR USE AS MEDICAMENTS AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1987-03-18 EP claimed
EP-0069018-B1 IODINE LABELLED RADIOACTIVE STILBENE DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION, AND THEIR USE IN RADIOIMMUNO ASSAYS ROUSSEL-UCLAF (FR) 1986-02-26 EP claimed
US-4489207-A DIHYDROXYBENZENE, 2-HALOFATTY ESTER OR ACYLOXIME BASF AKTIENGESELLSCHAFT (DE) 1984-12-18 US claimed