Dectaflur

Dectaflur

SCHEMBL28254263

CCCCCCCC/C=C\CCCCCCCCN.NC(c1ccccc1)c1ccccc1

nearest known ligand 0.45

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Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.44
SOAT2 O75908 1/20 0.43
SOAT1 P35610 1/20 0.43
SLC6A5 Q9Y345 3/20 0.42
FAAH O00519 1/20 0.42
EPHX2 P34913 1/20 0.42
DNM1 Q05193 4/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
EPHX1 P07099 1/20 0.41
HRH1 P35367 1/20 0.41

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
Oleamide SCHEMBL28254265 0.82 SOAT1 (0.64) SOAT2SOAT1FAAHEPHX2MEN1
Dectaflur SCHEMBL18548909 0.82 SOAT2 (0.47) SOAT2SOAT1SLC6A5FAAHEPHX2
Dectaflur SCHEMBL18548911 0.82 SOAT2 (0.47) SOAT2SOAT1SLC6A5FAAHEPHX2
Dectaflur SCHEMBL28590892 0.81 SOAT2 (0.46) SOAT2SOAT1SLC6A5FAAHEPHX2
Dectaflur SCHEMBL4227046 0.81 EPHX2 (0.50) SOAT2SOAT1SLC6A5FAAHEPHX2
Dectaflur SCHEMBL4227038 0.81 EPHX2 (0.50) SOAT2SOAT1SLC6A5FAAHEPHX2
SCHEMBL27590613 0.79 SLC2A1 (0.51) HTR2ASOAT2SOAT1FAAHEPHX2
SCHEMBL23621182 0.77 DNM1 (0.68) SOAT1SLC6A5FAAHDNM1MEN1
Dectaflur SCHEMBL21052121 0.77 DNM1 (0.68) SOAT1SLC6A5FAAHDNM1MEN1
Dectaflur SCHEMBL21052096 0.77 DNM1 (0.68) SOAT1SLC6A5FAAHDNM1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108884406-A Lubricating oil composition and metal working method 出光兴产株式会社 2018-11-23 CN disclosed