SCHEMBL781471

SCHEMBL781471

CCP(=O)(O)C=Cc1ccccc1F

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 9/20 0.48
RAB9A P51151 3/20 0.43
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
TRPA1 O75762 1/20 0.42
RECQL P46063 1/20 0.40
MAOB P27338 2/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL778419 0.84 RAB9A (0.47) NFE2L2RAB9AMAPTSMN1; SMN2NPC1
SCHEMBL779745 0.81 NFE2L2 (0.54) NFE2L2RAB9AMAPTSMN1; SMN2NPC1
SCHEMBL778166 0.81 NFE2L2 (0.46) NFE2L2RAB9AMAPTSMN1; SMN2NPC1
SCHEMBL2321543 0.75 GLA (0.47) RAB9AMAPTSMN1; SMN2NPC1L3MBTL1
SCHEMBL2321546 0.75 GLA (0.47) RAB9AMAPTSMN1; SMN2NPC1L3MBTL1
SCHEMBL779472 0.75 NFE2L2 (0.50) NFE2L2MAPTRECQLMAOBCYP1A2
SCHEMBL10031593 0.70 IAPP (0.60) NFE2L2RAB9AMAPTSMN1; SMN2NPC1
SCHEMBL1781201 0.69 MAPT (0.63) NFE2L2RAB9AMAPTSMN1; SMN2NPC1
SCHEMBL1781200 0.69 MAPT (0.63) NFE2L2RAB9AMAPTSMN1; SMN2NPC1
SCHEMBL31464870 0.69 MAPT (0.63) NFE2L2RAB9AMAPTSMN1; SMN2NPC1

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