SCHEMBL1789854

SCHEMBL1789854

CC(C)(C)c1ccc(CCCOC(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 3/20 0.49
LMNA P02545 2/20 0.49
ESRRG P62508 3/20 0.48
SLC13A5 Q86YT5 2/20 0.48
KCNH2 Q12809 1/20 0.47
COPS5 Q92905 1/20 0.45
EPHX2 P34913 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
NR4A2 P43354 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MITF O75030 1/20 0.43
ESRRB O95718 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL1789937 0.94 KCNH2 (0.49) NR1H4LMNAESRRGSLC13A5KCNH2
SCHEMBL1788418 0.90 ESRRG (0.50) NR1H4LMNAESRRGSLC13A5COPS5
SCHEMBL1789855 0.88 LMNA (0.50) NR1H4LMNAESRRGSLC13A5KCNH2
SCHEMBL28302379 0.87 LMNA (0.52) NR1H4LMNAESRRGSLC13A5KCNH2
SCHEMBL1789826 0.83 RXRA (0.42) NR1H4LMNANPC1RAB9ARXRA
SCHEMBL1789939 0.82 KCNH2 (0.50) NR1H4LMNAESRRGSLC13A5KCNH2
SCHEMBL16713295 0.82 LMNA (0.51) NR1H4LMNAESRRGSLC13A5KCNH2
SCHEMBL1788540 0.81 LMNA (0.46) LMNANPC1RAB9ARXRARXRB
SCHEMBL20717827 0.80 ESRRG (0.49) LMNAESRRGESRRB
SCHEMBL16673150 0.80 KCNH2 (0.51) NR1H4LMNAESRRGSLC13A5KCNH2

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