SCHEMBL779595

SCHEMBL779595

CCP(=O)(O)c1ccccc1-c1ccccc1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ADORA2A P29274 4/20 0.36
ADORA1 P30542 4/20 0.36
ADORA3 P0DMS8 3/20 0.36
ADORA2B P29275 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
CFTR P13569 1/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 2/20 0.33
RAB9A P51151 2/20 0.33
HSP90AA1 P07900 1/20 0.33
USP7 Q93009 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
SCHEMBL779586 0.84 TSHR (0.43) MAPTALDH1A1L3MBTL1HDAC3HDAC1
SCHEMBL776970 0.80 MAPT (0.38) MAPTALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL781242 0.80 MAPT (0.36) MAPTALDH1A1L3MBTL1CYP1A2CYP3A4
SCHEMBL18486705 0.79 ALDH1A1 (0.45) ALDH1A1L3MBTL1MEN1KMT2ACFTR
SCHEMBL17626552 0.79 CFTR (0.44) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL17223193 0.79 ALDH1A1 (0.51) MAPTALDH1A1L3MBTL1CYP3A4MEN1
SCHEMBL777564 0.74 CA2 (0.42) MAPTALDH1A1L3MBTL1CYP1A2CYP3A4
SCHEMBL969341 0.72 CFTR (0.39) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL6522210 0.72 GABRA1 (0.41) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL779531 0.70 CA2 (0.36) MAPTALDH1A1L3MBTL1MEN1KMT2A

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