SCHEMBL776173

SCHEMBL776173

CC(C)(CF)Sc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
MAPK1 P28482 2/20 0.37
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MGLL Q99685 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP2D6 P10635 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
PRMT1 Q99873 1/20 0.35
PTPN1 P18031 1/20 0.34
PTPRZ1 P23471 1/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
TAAR1 Q96RJ0 2/20 0.32
SLC6A2 P23975 1/20 0.32
FFAR1 O14842 1/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL14430941 0.79 ALDH1A1 (0.39) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL19622359 0.78 MAPT (0.41) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL10351871 0.77 ALDH1A1 (0.37) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL2945120 0.77 CYP1A2 (0.53) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL3935115 0.77 ALDH1A1 (0.37) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL2950715 0.77 ALDH1A1 (0.37) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
Barium SCHEMBL2729092 0.76 ALDH1A1 (0.36) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL1454164 0.76 ALDH1A1 (0.36) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL10498274 0.74 PTPRZ1 (0.39) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL285276 0.74 ALDH1A1 (0.34) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3621141-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2020-03-11 EP disclosed
EP-2597717-B1 NONAQUEOUS ELECTROLYTE FOR SECONDARY BATTERY AND NONAQUEOUS-ELECTROLYTE SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEM CORP (JP) 2018-07-25 EP 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-9093716-B2 Nonaqueous electrolyte for secondary battery and nonaqueous-electrolyte secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-28 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