Octane

Octane

SCHEMBL28017909

CCCCCCCC.O=C1C=CC(=O)N1

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.58
GSK3B P49841 1/20 0.58
CCR6 P51684 1/20 0.58
PTGS1 P23219 3/20 0.46
PTGS2 P35354 3/20 0.46
MGLL Q99685 3/20 0.46
FAAH O00519 1/20 0.46
TSHR P16473 1/20 0.42
THRB P10828 1/20 0.42
ACHE P22303 1/20 0.42
BACE1 P56817 1/20 0.42
GPR84 Q9NQS5 5/20 0.39
MMP2 P08253 4/20 0.39
MMP9 P14780 4/20 0.39
MMP3 P08254 2/20 0.39
MMP8 P22894 2/20 0.38
MMP13 P45452 2/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
Dodecane SCHEMBL5343400 1.00 GSK3A (0.58) GSK3AGSK3BCCR6PTGS1PTGS2
Decane SCHEMBL27647212 1.00 GSK3A (0.58) GSK3AGSK3BCCR6PTGS1PTGS2
Nonane SCHEMBL28072606 1.00 GSK3A (0.58) GSK3AGSK3BCCR6PTGS1PTGS2
Heptane SCHEMBL28031988 1.00 GSK3A (0.58) GSK3AGSK3BCCR6PTGS1PTGS2
Hexane SCHEMBL25298558 0.97 GSK3A (0.61) GSK3AGSK3BCCR6PTGS1PTGS2
Hexane SCHEMBL1232860 0.97 GSK3A (0.61) GSK3AGSK3BCCR6PTGS1PTGS2
Hexane SCHEMBL27934792 0.95 GSK3A (0.58) GSK3AGSK3BCCR6PTGS1PTGS2
Pentane SCHEMBL28032532 0.92 GSK3A (0.61) GSK3AGSK3BCCR6PTGS1PTGS2
Hexadecylamine SCHEMBL20360090 0.89 DNM1 (0.54) GSK3AGSK3BCCR6PTGS1PTGS2
Decanol SCHEMBL28133183 0.89 LMNA (0.54) GSK3AGSK3BCCR6PTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114381227-A Epoxy resin pouring sealant and preparation method thereof 王丽萍 2022-04-22 CN claimed
CN-114349924-B Self-repairing polyurethane and preparation method thereof 南京工业大学 2023-03-28 CN disclosed
CN-114381227-A Epoxy resin pouring sealant and preparation method thereof 王丽萍 2022-04-22 CN disclosed
CN-114381227-A Epoxy resin pouring sealant and preparation method thereof 王丽萍 2022-04-22 CN disclosed
CN-114349924-A Self-repairing polyurethane and preparation method thereof 南京工业大学 2022-04-15 CN disclosed
CN-107001801-B Addition-curable antistatic organopolysiloxane composition and antistatic silicone film 信越聚合物株式会社 2020-03-17 CN disclosed
CN-108028133-B The manufacturing method of conductive-polymer solution, capacitor and capacitor 信越聚合物株式会社 2019-08-13 CN disclosed
CN-108028133-A The manufacture method of conductive-polymer solution, capacitor and capacitor 信越聚合物株式会社 2018-05-11 CN disclosed
CN-104877127-B A kind of eight arms polyethyleneglycol derivative, preparation method and its bio-related substance of modification 厦门赛诺邦格生物科技股份有限公司 2017-11-10 CN disclosed
CN-107001801-A Addition hardening antistatic organopolysiloxane composition and antistatic silicone epithelium 信越聚合物株式会社 2017-08-01 CN disclosed
CN-104619805-B Antistatic release agent and antistatic release film 信越聚合物株式会社 2016-11-09 CN disclosed
CN-102708945-B Transparent conductive sheet for touch panel and manufacture method thereof and touch pad SHIN-ETSU POLYMER CO., LTD. (JP) 2015-09-30 CN disclosed
CN-104877127-A Eight-armed polyethylene glycol derivative, preparation method and related biological substance modified by derivative XIAMEN SINOPEG BIOTECH CO LTD 2015-09-02 CN disclosed
CN-104619805-A Antistatic release agent and antistatic release film SHINETSU POLYMER CO 2015-05-13 CN disclosed
CN-102708945-A Transparent conductive sheet for touch panel, method for manufacturing same and touch panel SHINETSU POLYMER CO 2012-10-03 CN disclosed
CN-101273417-A Transparent conductive sheet for touch panel, method for manufacturing same, and touch panel SHINETSU POLYMER CO (JP) 2008-09-24 CN disclosed