SCHEMBL8650508

SCHEMBL8650508

CC(OC(=O)CC(F)(F)F)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.49
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.41
LPAR1 Q92633 1/20 0.41
FFAR1 O14842 1/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HTT P42858 1/20 0.38
OPRM1 P35372 3/20 0.38
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37

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
SCHEMBL16673279 0.85 HCAR2 (0.50) HCAR2KDM4EMAPTTSHRLPAR1
SCHEMBL3883004 0.80 HCAR2 (0.56) HCAR2KMT2AMEN1KDM4EMAPT
SCHEMBL11461421 0.80 HCAR2 (0.56) HCAR2KMT2AKDM4EMAPTTSHR
SCHEMBL27774184 0.79 HCAR2 (0.54) HCAR2KMT2AKDM4EMAPTTSHR
SCHEMBL538486 0.79 HCAR2 (0.54) HCAR2KMT2AMEN1KDM4EMAPT
SCHEMBL27701745 0.79 HCAR2 (0.54) HCAR2KMT2AKDM4EMAPTTSHR
SCHEMBL9231000 0.79 HCAR2 (0.54) HCAR2KMT2AMEN1KDM4EMAPT
SCHEMBL25209436 0.78 KDM4E (0.44) HCAR2KMT2AMEN1KDM4EMAPT
SCHEMBL6947823 0.78 MAPT (0.51) HCAR2KMT2AMEN1KDM4EMAPT
SCHEMBL2169192 0.78 MTNR1A (0.42) KMT2AMEN1MAPTTSHRPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2869389-B1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTIC SOLUTION CELL USING SAME MITSUBISHI CHEM CORP (JP) 2019-11-13 EP disclosed
US-10320030-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2019-06-11 US disclosed
US-20150140448-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2015-05-21 US disclosed
EP-2869389-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTIC SOLUTION CELL USING SAME Mitsubishi Chemical Corporation (JP) 2015-05-06 EP disclosed
EP-0592669-B1 OPTICALLY ACTIVE TRIFLUOROLACTIC ACID DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 1998-01-28 EP disclosed