Hexane

Hexane

SCHEMBL4283926

CCCCCC.CNC

nearest known ligand 0.00

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⚠ 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
Decane SCHEMBL27438922 0.95 TSHR (0.73)
Dimethylamine SCHEMBL27525398 0.95 TSHR (0.73)
Heptane SCHEMBL5948852 0.95 TSHR (0.73)
Dimethylamine SCHEMBL563086 0.95 TSHR (0.73)
Dodecane SCHEMBL3403004 0.95 TSHR (0.73)
Tetradecane SCHEMBL8957739 0.95 TSHR (0.73)
Hexadecane SCHEMBL634764 0.95 TSHR (0.73)
Octane SCHEMBL638968 0.95 TSHR (0.73)
Undecane SCHEMBL11852538 0.95 TSHR (0.73)
Hexane SCHEMBL7788123 0.95 TSHR (0.58)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109265669-A A kind of preparation method of double transmitting fluorescence nano grains 西安交通大学 2019-01-25 CN claimed
CN-109174061-A A kind of preparation method of the modified seperation film of heavy metal ion adsorbed type PVDF 天津市金鳞水处理科技有限公司 2019-01-11 CN claimed
CN-109174062-A A kind of modified seperation film of heavy metal ion adsorbed type PVDF 天津市金鳞水处理科技有限公司 2019-01-11 CN claimed
CN-108760704-A A kind of unicellular interior substance detecting method based on Whispering-gallery-mode 北京工业大学 2018-11-06 CN claimed
CN-108456239-A Compound BA-X with antitumor action and its preparation method and application 雷鹏程 2018-08-28 CN claimed
CN-108102101-A A kind of smooth reversible crosslink organic siliconresin and preparation method thereof 闽江学院 2018-06-01 CN claimed
CN-107325123-A Polyhedral oligomeric silsesquioxane containing multiple alkenyl or alkynyls and preparation method thereof 北京化工大学 2017-11-07 CN claimed
CN-114773403-B Synthesis method of tri (dialkylamino) cyclopentadienyl metal complex 苏州欣诺科生物科技有限公司 2024-01-05 CN disclosed
CN-117164618-A Preparation method of metal complex precursor and metal oxide film 苏州欣诺科生物科技有限公司 2023-12-05 CN disclosed
US-20230287015-A1 1,1,1-TRIS(ORGANOAMINO)DISILANE COMPOUNDS AND METHOD OF PREPARING SAME JIANGSU NATA OPTO-ELECTRONIC MATERIALS CO. LTD. (CN) 2023-09-14 US disclosed
US-20230279028-A1 1,1,1-TRIS(ORGANOAMINO)DISILANE COMPOUNDS AND METHOD OF PREPARING SAME JIANGSU NATA OPTO-ELECTRONIC MATERIALS CO. LTD. (CN) 2023-09-07 US disclosed
US-11691993-B2 1,1,1-tris(organoamino)disilane compounds and method of preparing same JIANGSU NATA OPTO-ELECTRONIC MATERIALS CO. LTD. (CN) 2023-07-04 US disclosed
CN-116143846-A Titanium precursor, preparation method and application thereof 苏州欣诺科生物科技有限公司 2023-05-23 CN disclosed
CN-1399631-A Novel hydantoin, thiohydantoin, pyrimidinedione and thioxopyrimidinone derivatives, preparation method and use as medicines SOD CONSEILS RECH APPLIC (FR) 2003-02-26 CN disclosed
US-20030013913-A1 Chemical compound, method for the production thereof and its use in catalyst systems for producing polyolefins EQUISTAR CHEMICALS, LP 2003-01-16 US disclosed
EP-0999856-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION Du Pont Pharmaceuticals Company (US) 2000-05-17 EP disclosed
CN-1239895-A Radiopharmaceuticals for imaging sites of infection and inflammation DU PONT MERCK PHARMA (US) 1999-12-29 CN disclosed
US-5925728-A COSMETICS FOR HAIR BASF AKTIENGESELLSCHAFT (DE) 1999-07-20 US disclosed
WO-1998015295-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION DUPONT PHARMACEUTICALS COMPANY (US) 1998-04-16 WO disclosed
US-4311799-A DIVINYLBENZENE, AMINOETHYLSTYRENE DERIVATIVE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1982-01-19 US disclosed