SCHEMBL779151

SCHEMBL779151

C=CCC(c1ccccc1F)P(=O)(O)O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.39
ACP3 P15309 8/20 0.37
CYP2C19 P33261 2/20 0.37
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
CNR2 P34972 2/20 0.35
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
MEN1 O00255 2/20 0.33
CYP2C9 P11712 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
GAA P10253 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
SCHEMBL779298 0.81 CYP2C19 (0.38) CYP3A4ACP3CYP2C19CES2CES1
SCHEMBL21616477 0.78 CYP3A4 (0.42) CYP3A4ACP3CES2CES1CNR2
SCHEMBL777837 0.77 CYP2C19 (0.35) CYP3A4CYP2C19CES2CES1CNR2
SCHEMBL9449512 0.76 ACP3 (0.58) ACP3CYP2C19ALOX15TSHR
SCHEMBL776251 0.75 CYP3A4 (0.39) CYP3A4ACP3CES2CES1CNR2
SCHEMBL777705 0.74 CYP3A4 (0.39) CYP3A4ACP3CYP2C19CES2CES1
SCHEMBL20645828 0.74 CES2 (0.41) CYP3A4CYP2C19CES2CES1CNR2
SCHEMBL30955355 0.74 CES2 (0.41) CYP3A4CYP2C19CES2CES1CNR2
SCHEMBL777580 0.73 ACP3 (0.53) CYP3A4ACP3CNR2
SCHEMBL779297 0.72 DPP4 (0.37) CYP2C19ALDH1A1

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