Dioxane

Dioxane

SCHEMBL27658709

C1COCCO1.C1COCN1

nearest known ligand 0.69

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Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.69
KMT2A Q03164 1/20 0.69
GAA P10253 2/20 0.59
KDM4E B2RXH2 1/20 0.59
CYP2C9 P11712 1/20 0.59
TTR P02766 1/20 0.40
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
APEX1 P27695 1/20 0.33

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
Morpholine SCHEMBL27766294 0.93 MEN1 (0.69) MEN1KMT2AGAAKDM4ECYP2C9
Oxazolidine SCHEMBL130963 0.93
Oxazolidine SCHEMBL27546418 0.93
Oxazolidine SCHEMBL22743 0.93
Oxazolidine SCHEMBL13270005 0.93 MEN1 (0.56) MEN1KMT2AGAAKDM4ECYP2C9
Oxazolidine SCHEMBL11115505 0.90
Oxazolidine SCHEMBL2459396 0.90
Oxazolidine SCHEMBL21874428 0.90
Oxazolidine SCHEMBL6659443 0.90
Oxazolidine SCHEMBL7695088 0.90 MEN1 (0.53) MEN1KMT2AGAAKDM4ECYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102026541-A Improved corrosion and microbial control in hydrocarbonaceous compositions ANGUS CHEMICAL 2011-04-20 CN claimed
CN-102026541-A Improved corrosion and microbial control in hydrocarbonaceous compositions ANGUS CHEMICAL 2011-04-20 CN disclosed
CN-100480249-C Pyrrolopyridine-2-carboxylic acid amides as glycogen phosphorylase inhibitors PROSIDION LTD (GB) 2009-04-22 CN disclosed
CN-1898235-A Heterocyclic derivatives as gpcr receptor agonists PROSIDION LTD (GB) 2007-01-17 CN disclosed
CN-1826340-A Pyrrolopyridine-2-carboxylic acid amides as glycogen phosphorylase inhibitors PROSIDION LTD (GB) 2006-08-30 CN disclosed