SCHEMBL1150832

SCHEMBL1150832

CN1C=CNC=C1

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
Iodide SCHEMBL7541508 0.96
SCHEMBL10017669 0.63
SCHEMBL21873797 0.62
SCHEMBL29865 0.62
SCHEMBL3402842 0.61
SCHEMBL2004962 0.61
SCHEMBL1426403 0.61
SCHEMBL832772 0.60
SCHEMBL21480224 0.59
SCHEMBL23234265 0.58 MEN1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117497827-A Secondary battery and electricity utilization device 东莞新能源科技有限公司 2024-02-02 CN claimed
CN-116332856-A Synthesis method of 4-pyridazine methanol 荟达医药科技(上海)有限公司 2023-06-27 CN claimed
CN-116265438-A Synthesis method of 5-HT6 receptor molecule based on C-N-axis indole olefin axial chirality 南京理工大学 2023-06-20 CN claimed
CN-114075104-A Method for producing oxalate phosphate, oxalate phosphate derivative, method for producing oxalate phosphate derivative, and electrolyte salt 恒大新能源技术(深圳)有限公司 2022-02-22 CN claimed
CN-114075226-A Preparation method of oxalato borate, oxalato borate derivative, preparation method of oxalato borate derivative and electrolyte salt 恒大新能源技术(深圳)有限公司 2022-02-22 CN claimed
CN-114075246-A Method for producing bisoxalato phosphate, bisoxalato phosphate derivative, method for producing bisoxalato phosphate derivative, and electrolyte salt 恒大新能源技术(深圳)有限公司 2022-02-22 CN claimed
CN-113429329-A Purification method of semiconductor grade N-methyl pyrrolidone 镇江润晶高纯化工科技股份有限公司 2021-09-24 CN claimed
US-20210138117-A1 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2021-05-13 US claimed
US-20210094954-A1 PREPARATION METHODS AND APPLICATIONS OF 3,5-DISUBSTITUTED METHYLPYRAZOLO[1,5-A]PYRIMIDINE-7-HYDROXYLIC SALTS XU LIFENG (US) 2021-04-01 US claimed
EP-3038621-A2 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR Human Biomolecular Research Institute (US) 2016-07-06 EP claimed
US-20160038641-A1 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2016-02-11 US claimed
CN-104245698-A Nitrogen-containing heterocyclic compound TAKEDA PHARMACEUTICAL 2014-12-24 CN claimed
WO-2014146039-A2 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2014-09-18 WO claimed
CN-103371347-B Reactive egg essence and application thereof BELL FLAVORS & FRAGRANCES SHANGHAI CO LTD 2014-09-17 CN claimed
CN-103371347-A Reactive egg essence and application thereof BELL FLAVORS & FRAGRANCES SHANGHAI CO LTD 2013-10-30 CN claimed
CN-101289482-B Cambogic acid glycoside derivates and the like, preparation and uses thereof LIAONING LIFENG TECHNOLOGY AND DEV CO LTD 2011-08-31 CN claimed
US-20110038952-A1 GAMBOGIC ACID GLYCOSIDE DERIVATIVES AND ANALOGS, THEIR PREPARATION METHODS AND APPLICATIONS XU LIFENG 2011-02-17 US claimed
CN-101289482-A Cambogic acid glycoside derivates and the like, preparation and uses thereof LIAONING LIFENG TECHNOLOGY AND (CN) 2008-10-22 CN claimed
CN-116265438-B Synthesis method of 5-HT6 receptor molecule based on C-N-axis indole olefin axial chirality 南京理工大学 2024-10-29 CN disclosed
EP-0227088-A1 Isoxazolo-naphthyridine, isoxazolo quinoline, isothiazolonaphthyridine, and isothiazoloquinoline derivatives ABBOTT LABORATORIES (US) 1987-07-01 EP disclosed