SCHEMBL779745

SCHEMBL779745

CP(=O)(O)C=Cc1ccccc1F

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 11/20 0.54
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP1B1 Q16678 1/20 0.44
MAOB P27338 2/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RELA Q04206 1/20 0.41
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 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
SCHEMBL781471 0.81 NFE2L2 (0.48) NFE2L2CYP1A2MAOBNPC1MAPT
SCHEMBL779472 0.79 NFE2L2 (0.50) NFE2L2CYP1A2CYP2D6CYP1B1MAOB
SCHEMBL778419 0.76 RAB9A (0.47) NFE2L2NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL778166 0.75 NFE2L2 (0.46) NFE2L2CYP1A2CYP2D6CYP1B1MAOB
SCHEMBL778451 0.73 NFE2L2 (0.43) NFE2L2CYP1A2CYP2D6CYP1B1MAOB
SCHEMBL11436666 0.72 GLA (0.47) CYP1A2CYP2D6CYP1B1MAOBNPC1
SCHEMBL28056101 0.72 NFE2L2 (0.50) NFE2L2CYP1A2MAOBNPC1RAB9A
SCHEMBL10040049 0.72 GLA (0.47) CYP1A2CYP2D6CYP1B1MAOBNPC1
SCHEMBL2234105 0.72 NFE2L2 (1.00) NFE2L2MAOBNPC1RAB9ASMN1; SMN2
SCHEMBL22778017 0.70 PTGS2 (0.43) NFE2L2MAOBGRIN2DGRIN3BGRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-9343777-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-05-17 US disclosed
US-9252457-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-02-02 US disclosed
US-20150188192-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-02 US disclosed
US-20120070731-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-03-22 US disclosed
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed