Cyclohexane

Cyclohexane

SCHEMBL6265334

C1CCCCC1.O=CO

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
Cyclopentane SCHEMBL10524012 1.00
Cyclopentane SCHEMBL30979206 1.00 ADH1B (0.30)
Cycloheptane SCHEMBL11874125 1.00 ADH1B (0.30)
Cyclooctane SCHEMBL7940492 1.00 ADH1B (0.30)
Cyclohexane SCHEMBL6265151 1.00 ADH1B (0.30)
Cyclopropane SCHEMBL1078223 1.00
Formic Acid SCHEMBL28727189 0.95
Cyclopentane SCHEMBL28347582 0.95
Cyclohexane SCHEMBL28817900 0.83 ALDH1A1 (0.31)
Formic Acid SCHEMBL6684167 0.82 ALDH1A1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250212873-A1 VOLATILE HDAC INHIBITORS FOR THERAPEUTIC AND PLANT APPLICATIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-07-03 US claimed
CN-119463644-A High-performance sound insulation coating and preparation method thereof 中铁建设集团南方工程有限公司 2025-02-18 CN claimed
EP-4482306-A1 VOLATILE HDAC INHIBITORS FOR THERAPEUTIC AND PLANT APPLICATIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-01-01 EP claimed
CN-114952608-B Fixed abrasive grinding pad based on photoinitiated front-end polymerization reaction and preparation method thereof 郑州磨料磨具磨削研究所有限公司 2024-10-01 CN claimed
CN-118685141-A Epoxy sealant for new energy automobile and preparation method thereof 安徽固创新材料科技有限公司 2024-09-24 CN claimed
WO-2023192424-A1 VOLATILE HD AC INHIBITORS FOR THERAPEUTIC AND PLANT APPLICATIONS CROSS-REFERENCE TO RELATED APPLICATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-10-05 WO claimed
CN-111087495-B Hydrogenation catalyst for producing hydrogenated styrene-conjugated diene copolymer, method for producing hydrogenation catalyst, hydrogenation method, and hydrogenated copolymer 中国石油化工股份有限公司 2023-03-14 CN claimed
CN-111085269-B Hydrogenation catalyst for preparing cyclopentene by cyclopentadiene hydrogenation, preparation method and hydrogenation method thereof 中国石油化工股份有限公司 2023-03-14 CN claimed
CN-111085273-B Hydrogenation catalyst for preparing cyclopentene by cyclopentadiene hydrogenation, preparation method and hydrogenation method thereof 中国石油化工股份有限公司 2023-02-28 CN claimed
CN-108117478-B Process for the preparation of 1, 4-cyclohexanedimethanol or 1, 4-cyclohexanedicarboxylic acid 中国科学院大连化学物理研究所 2021-02-05 CN claimed
US-6943267-B1 compounds structurally resemble the substrates of the enzymes, but have nonhydrolyzable mono protonated thiophosphonate salts; chromatography or distillations not required UTAH STATE UNIVERSITY (US) 2005-09-13 US claimed
CN-1640906-A Urea-formaldehyde adhesive with low free formaldehyde and expanding characteristic and its preparation method NI ZHUO (CN) 2005-07-20 CN claimed
CN-1640907-A Low formaldehyde melamine adhesive with expanding characteristic and preparation method NI ZHUO (CN) 2005-07-20 CN claimed
CN-1195725-C Selective hydrogenation for preparing hexabydrobenzoic acid from benzoic acid CHINA PETROCHEMICAL CORP (CN) 2005-04-06 CN claimed
US-20050049431-A1 Thiophosphonate inhibitors of phosphatase enzymes and metallophosphatases UTAH STATE UNIVERSITY 2005-03-03 US claimed
CN-1142016-C Catalyst for preparation of hexahydrobenzoic acid by hydrogenation of benzoic acid 中国石油化工股份有限公司 2004-03-17 CN claimed
CN-1406666-A Catalyst for preparation of hexahydrobenzoic acid by hydrogenation of benzoic acid CHINA PETROCHEMICAL CORP (CN) 2003-04-02 CN claimed
CN-1406921-A Selective hydrogenation for preparing hexabydrobenzoic acid from benzoic acid CHINA PETROCHEMICAL CORP (CN) 2003-04-02 CN claimed
CN-1112719-A Polyvinyl chloride extrusion compounds free of heavy metals and articles therefrom GEON CO (US) 1995-11-29 CN claimed
CN-85106087-A The synthesis technique of componds of substituted-formyl-anthracene cyclic esters 1987-02-04 CN claimed