SCHEMBL45855

SCHEMBL45855

BrCCC1OCCO1

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
SCHEMBL14128211 1.00
SCHEMBL6098133 0.97
SCHEMBL19637964 0.97
Bromide SCHEMBL28265120 0.94
SCHEMBL28265119 0.92
SCHEMBL628132 0.88
Magnesium SCHEMBL31150762 0.86 MEN1 (0.31)
SCHEMBL889477 0.82
SCHEMBL1061060 0.80 ALDH1A1 (0.31)
SCHEMBL6907900 0.79

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 1541 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119330816-A Novel preparation method of cis-6-nonenal 安徽华业香料合肥有限公司 2025-01-21 CN claimed
CN-117756843-A Preparation method of alkyl germanium based on olefin difunctional 南京信息工程大学 2024-03-26 CN claimed
CN-116763673-B Collagen permeation promoter and preparation method and application thereof 纵横星购(北京)生物科技有限公司 2024-02-23 CN claimed
CN-116144724-A Composite peptide and spray for rehabilitation of tumor patients and preparation method thereof 养系列(山东)生物科技有限公司 2023-05-23 CN claimed
CN-115286522-A Ionic liquid and preparation method and application thereof 浙江大学 2022-11-04 CN claimed
CN-113105425-B Anti-inflammatory compound, preparation method and anti-inflammatory application thereof 东北大学 2022-07-01 CN claimed
CN-113105489-B Hydroxyl carborane derivative containing ether bond, modified curing agent, and preparation method and application thereof 华南理工大学 2022-06-14 CN claimed
CN-113105489-A Hydroxyl carborane derivative containing ether bond, modified curing agent, and preparation method and application thereof 华南理工大学 2021-07-13 CN claimed
CN-106748958-B A kind of preparation method of Rucaparib intermediate 伦俊杰 2018-12-18 CN claimed
CN-106748958-A A kind of preparation method of Rucaparib intermediates 青岛辰达生物科技有限公司 2017-05-31 CN claimed
WO-2003040121-A1 METHODS FOR TREATING DEPRESSION AND OTHER CNS DISORDERS USING ENANTIOMERICALLY ENRICHED DESMETHYL- AND DIDESMETHYL-METABOLITES OF CITALOPRAM SEPRACOR, INC. (US) 2003-05-15 WO claimed
JP-2003501431-A 2003-01-14 JP claimed
EP-1181291-A2 DNA METHYLTRANSFERASE INHIBITORS THE PENN STATE RESEARCH FOUNDATION (US) 2002-02-27 EP claimed
WO-2000075142-A2 DNA METHYLTRANSFERASE INHIBITORS THE PENN STATE RESEARCH FOUNDATION (US) 2000-12-14 WO claimed
US-5731435-A Process for the preparation of heterocyclic alkylamide derivatives G. D. SEARLE & CO. (US) 1998-03-24 US claimed
CN-1037604-C Method for preparing anti-asthmatic and antitussive medicine PHARMIC INST CHINESE MEDICAL S (CN) 1998-03-04 CN claimed
WO-1996040616-A1 HIGH AFFINITY TAMOXIFEN DERIVATIVES AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1996-12-19 WO claimed
EP-0501912-B1 Methyldioxolane CIBA GEIGY AG (CH) 1996-08-14 EP claimed
CN-1116625-A Method for preparing anti-asthmatic and antitussive medicine PHARMIC INST CHINESE ACADEMY O (CN) 1996-02-14 CN claimed
WO-1994027955-A1 INTERMEDIATES AND PROCESS OF MAKING DIPEPTIDE ISOSTERES SMITHKLINE BEECHAM CORPORATION (US) 1994-12-08 WO claimed