SCHEMBL777331

SCHEMBL777331

COP(=O)(CC(F)(F)F)c1ccccc1F

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UTRN P46939 2/20 0.33
CYP3A4 P08684 1/20 0.31
CA2 P00918 1/20 0.31
HPGD P15428 1/20 0.30
NPC1 O15118 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
HTT P42858 2/20 0.30
XBP1 P17861 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL29468640 1.00 UTRN (0.33) UTRNCYP3A4CA2HPGDNPC1
SCHEMBL779986 0.84 AOX1 (0.38) CA2HPGDPOLBNPSR1
SCHEMBL29468662 0.84 AOX1 (0.38) CA2HPGDPOLBNPSR1
SCHEMBL779899 0.83 HTT (0.38) CYP3A4SMN1; SMN2HTT
SCHEMBL29468608 0.83 HTT (0.38) CYP3A4SMN1; SMN2HTT
SCHEMBL777979 0.81 UTRN (0.46) UTRNCYP3A4CA2L3MBTL1HTT
SCHEMBL779317 0.79 MEN1 (0.40) CYP3A4LMNANPSR1
SCHEMBL29468603 0.79 MEN1 (0.40) CYP3A4LMNANPSR1
SCHEMBL777510 0.78 HTT (0.37) UTRNCYP3A4SMN1; SMN2HTTXBP1
SCHEMBL779383 0.78 HTT (0.37) CYP3A4CA2HPGDSMN1; SMN2HTT

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