SCHEMBL777069

SCHEMBL777069

CCCC(c1ccccc1)(c1ccccc1F)P(=O)(O)O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.42
KCNN4 O15554 5/20 0.42
KCNE1 P15382 1/20 0.38
KCNQ1 P51787 1/20 0.38
PGK1 P00558 3/20 0.37
PGK2 P07205 3/20 0.37
PTPN5 P54829 3/20 0.36
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KIF11 P52732 2/20 0.34
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC6 Q9UBN7 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
SCHEMBL781360 0.92 KCNN4 (0.44) PTPN1KCNN4KCNE1KCNQ1PGK1
SCHEMBL776691 0.91 FDPS (0.37) PTPN1KCNN4KCNE1KCNQ1PGK1
SCHEMBL874648 0.84 PTPN1 (0.48) PTPN1PGK1PGK2PTPN5ALDH1A1
SCHEMBL8538943 0.73 PTPN1 (0.52) PTPN1PGK1PGK2PTPN5ALDH1A1
SCHEMBL777638 0.73 PTPN1 (0.48) PTPN1KCNN4KCNE1KCNQ1PGK1
SCHEMBL778562 0.72 HDAC3 (0.33) PTPN1KCNN4KDM4EALDH1A1HDAC3
SCHEMBL18113458 0.72 KCNN4 (0.46) KCNN4KCNE1KCNQ1ALDH1A1KIF11
SCHEMBL3234321 0.72 FDPS (0.40) KCNN4ALDH1A1
SCHEMBL777835 0.70 ALDH1A1 (0.32) KCNN4ALDH1A1HDAC3HDAC1HDAC2
SCHEMBL777522 0.69 PTPN1 (0.52) PTPN1KCNN4KCNE1KCNQ1PGK1

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 7 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-20120177988-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-07-12 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