SCHEMBL1789201

SCHEMBL1789201

CC(C)(C)c1ccccc1OC(=O)OC(F)CF

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 4/20 0.47
GAA P10253 3/20 0.47
TDP1 Q9NUW8 3/20 0.47
ATM Q13315 1/20 0.47
NPSR1 Q6W5P4 2/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
BCHE P06276 1/20 0.42
NAMPT P43490 1/20 0.41
MAPT P10636 2/20 0.40
HTT P42858 2/20 0.40
MAPK1 P28482 1/20 0.40
RBP4 P02753 3/20 0.40
ALOX15 P16050 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 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
SCHEMBL1788853 0.84 TDP1 (0.50) KDM4EALDH1A1GAATDP1ATM
SCHEMBL1791770 0.81 PTGDR2 (0.38) KDM4EALDH1A1GAATDP1ATM
SCHEMBL47807 0.79 TDP1 (0.62) KDM4EALDH1A1GAATDP1ATM
SCHEMBL30134334 0.79 TDP1 (0.62) KDM4EALDH1A1GAATDP1ATM
SCHEMBL1790089 0.78 TDP1 (0.48) KDM4EALDH1A1GAATDP1ATM
SCHEMBL1787562 0.78 TDP1 (0.48) KDM4EALDH1A1GAATDP1ATM
SCHEMBL17923940 0.78 TDP1 (0.57) KDM4EALDH1A1GAATDP1ATM
SCHEMBL1789571 0.75 ATM (0.51) KDM4EALDH1A1GAATDP1ATM
SCHEMBL1205809 0.75 TDP1 (0.57) KDM4EALDH1A1GAATDP1ATM
SCHEMBL1790584 0.74 TDP1 (0.53) KDM4EALDH1A1GAATDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2249426-B1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEM CORP (JP) 2019-07-10 EP disclosed
US-9083058-B2 Nonaqueous electrolytic solution and nonaqueous-electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-14 US disclosed
US-8916298-B2 Nonaqueous electrolytic solution and nonaqueous-electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2014-12-23 US disclosed
US-8889302-B2 Nonaqueous electrolytic solution and nonaqueous-electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2014-11-18 US disclosed
US-8846254-B2 2014-09-30 US disclosed
US-20140134481-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2014-05-15 US disclosed
US-20120308883-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-12-06 US disclosed
US-20120219854-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-30 US disclosed
US-20110123871-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY MITSUBISHI CHEMCIAL (JP) 2011-05-26 US disclosed
EP-2249426-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY Mitsubishi Chemical Corporation (JP) 2010-11-10 EP disclosed