SCHEMBL777941

SCHEMBL777941

CCP(=O)(O)c1ccccc1CC(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN5 P54829 1/20 0.40
FDPS P14324 2/20 0.36
PTPN1 P18031 1/20 0.35
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
PKM P14618 1/20 0.34
TSHR P16473 1/20 0.34
PGK1 P00558 3/20 0.33
PGK2 P07205 3/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
CFTR P13569 1/20 0.32

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
SCHEMBL779751 0.85 FDPS (0.37) PTPN5FDPSPTPN1PGK1PGK2
SCHEMBL777623 0.84 TSHR (0.43) PTPN5TSHR
SCHEMBL776500 0.83 PTPN5 (0.38) PTPN5FDPSPTPN1GABRA1GABRB2
SCHEMBL6522210 0.82 GABRA1 (0.41) PTPN5GABRA1GABRB2MEN1KMT2A
SCHEMBL777944 0.78 PTPN5 (0.40) PTPN5FDPSPTPN1GABRA1GABRB2
SCHEMBL17626552 0.78 CFTR (0.44) FDPSMEN1KMT2AALDH1A1GAA
SCHEMBL777166 0.77 FDPS (0.43) PTPN5FDPSPTPN1MEN1KMT2A
SCHEMBL2486285 0.76 CYP1A2 (0.37) PTPN1MEN1KMT2AALDH1A1GAA
SCHEMBL778912 0.75 TSHR (0.44) PTPN5FDPSPTPN1GABRA1GABRB2
SCHEMBL781245 0.75 PGK1 (0.35) PTPN5FDPSPTPN1ALDH1A1PGK1

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