Octane

Octane

SCHEMBL8988185

B.CCCCCCCC

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 SCHEMBL23174724 1.00 TSHR (0.89)
Decane SCHEMBL5084996 1.00 TSHR (0.89)
Nonane SCHEMBL27486798 1.00 TSHR (0.89)
SCHEMBL23174725 1.00 TSHR (0.89)
Heptane SCHEMBL8568059 1.00
Heptane SCHEMBL28095754 0.95
Heptane SCHEMBL23091221 0.95 TSHR (0.80)
Heptane SCHEMBL17968620 0.95 TSHR (0.80)
Tetradecane SCHEMBL23924271 0.94 TSHR (1.00)
Hexadecane SCHEMBL23499901 0.94 TSHR (1.00)

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117757038-A Copolymer electrolyte material and preparation method and application thereof 华东理工大学 2024-03-26 CN claimed
CN-115915807-A Electroluminescent device and display device TCL科技集团股份有限公司 2023-04-04 CN claimed
CN-117757038-A Copolymer electrolyte material and preparation method and application thereof 华东理工大学 2024-03-26 CN disclosed
CN-115915807-A Electroluminescent device and display device TCL科技集团股份有限公司 2023-04-04 CN disclosed
CN-101903310-A Method for producing organic compound and organic compound obtained thereby M TECH CO LTD 2010-12-01 CN disclosed
US-5494918-A ANTICHOLESTEROL AGENTS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-02-27 US disclosed
US-5385912-A Hypocholesterolemic or hypolipidemic agents RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-01-31 US disclosed
WO-1992015579-A1 MULTICYCLIC TERTIARY AMINE POLYAROMATIC SQUALENE SYNTHETASE INHIBITORS RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-09-17 WO disclosed