Hexane

Hexane

SCHEMBL2146002

CCCCCC.[C]

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
Nonane SCHEMBL30309799 0.94 TSHR (0.89)
Charcoal, Activated SCHEMBL31513512 0.94 TSHR (0.89)
Hexadecane SCHEMBL8539230 0.94 TSHR (0.89)
Hexane SCHEMBL9436086 0.94 TSHR (0.70)
Tetradecane SCHEMBL7856354 0.94 TSHR (0.89)
Charcoal, Activated SCHEMBL3664946 0.94 TSHR (0.89)
Heptane SCHEMBL1169629 0.94
Charcoal, Activated SCHEMBL31557734 0.94 TSHR (0.89)
Hexane SCHEMBL9722743 0.94 TSHR (0.78)
Decane SCHEMBL29490016 0.94 TSHR (0.89)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4713017-A1 CHIMERIC MOLECULE UCL Business Ltd (GB) 2026-03-25 EP disclosed
US-20250320429-A1 SOLID COMPOSITION, LIQUID AND VISCOUS CLEANING FORMULATION OBTAINED BY DISSOLVING THE SOLID COMPOSITION, METHODS FOR PREPARING, DISTRIBUTING AND USE OF A LIQUID AND VISCOUS CLEANING FORMULATION OXITENO S.A. INDÚSTRIA E COMÉRCIO (BR) 2025-10-16 US disclosed
WO-2024236326-A1 CHIMERIC MOLECULE UCL BUSINESS LTD (GB) 2024-11-21 WO disclosed
EP-4352190-A1 SOLID COMPOSITION, LIQUID AND VISCOUS CLEANING FORMULATION OBTAINED BY DISSOLVING THE SOLID COMPOSITION, METHODS FOR PREPARING, DISTRIBUTING AND USE OF A LIQUID AND VISCOUS CLEANING FORMULATION Oxiteno S.A. Indústria e Comércio (BR) 2024-04-17 EP disclosed
CN-115181264-B Benzoxazine intermediate and preparation method thereof, and preparation method of polybenzoxazine resin 中国航空工业集团公司济南特种结构研究所 2023-05-23 CN disclosed
WO-2022236388-A1 SOLID COMPOSITION, LIQUID AND VISCOUS CLEANING FORMULATION OBTAINED BY DISSOLVING THE SOLID COMPOSITION, METHODS FOR PREPARING, DISTRIBUTING AND USE OF A LIQUID AND VISCOUS CLEANING FORMULATION OXITENO S.A. INDÚSTRIA E COMÉRCIO (BR) 2022-11-17 WO disclosed
CN-115181264-A Benzoxazine intermediate, preparation method thereof and preparation method of polybenzoxazine resin 中国航空工业集团公司济南特种结构研究所 2022-10-14 CN disclosed
CN-105355860-B Negative electrode of lead-carbon battery 中国电力科学研究院 2021-10-15 CN disclosed
CN-105489887-B Negative lead paste of lead-carbon battery 中国电力科学研究院 2020-07-24 CN disclosed
CN-110191709-A It can be used as the compound of indole amine 2,3-dioxygenase and/or tryptophan dioxygenase inhibitor 德州大学系统董事会 2019-08-30 CN disclosed
US-20120288958-A1 Carbon Laminated Materials for Sample Preparation THOMPSON JONATHAN (US) 2012-11-15 US disclosed
CN-101891184-B Method for continuously synthesizing single-wall carbon nano tube by high temperature chemical vapor deposition method UNIV TONGJI 2012-07-25 CN disclosed
WO-2011088453-A1 CARBON LAMINATED MATERIALS FOR SAMPLE PREPARATION THOMPSON JONATHAN (US) 2011-07-21 WO disclosed
CN-102070618-A Compound and crystals thereof HUTCHISON MEDIPHARM SHANGHAI LTD 2011-05-25 CN disclosed
CN-101891184-A Method for continuously synthesizing single-wall carbon nano tube by high temperature chemical vapor deposition method UNIV TONGJI 2010-11-24 CN disclosed
US-5292987-A Increasing dimethyl-branched paraffin content, multistage UOP (US) 1994-03-08 US disclosed
US-5128426-A Gel-free, hot melt adhesives, with isoprene TOSOH CORPORATION (JP) 1992-07-07 US disclosed
US-5116794-A Method for enhancing the activity of zeolite beta UOP (US) 1992-05-26 US disclosed
US-5055633-A Separating isopentane and dimethylhexanes by adsorption of impurities; octane rating UOP (US) 1991-10-08 US disclosed
US-5055634-A Separating isopentane and di-methyl branched hexane paraffins from hydrocarbon feed UOP (US) 1991-10-08 US disclosed