SCHEMBL1789495

SCHEMBL1789495

CC(C)(C)c1cccc(C(F)OC(=O)OC(F)c2cccc(C(C)(C)C)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.51
HDAC8 Q9BY41 3/20 0.41
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
CES2 O00748 1/20 0.38
ACP3 P15309 1/20 0.38
HDAC6 Q9UBN7 2/20 0.36
CTSD P07339 1/20 0.36
BACE1 P56817 1/20 0.36
HDAC3 O15379 1/20 0.36
PGK1 P00558 1/20 0.36
PGK2 P07205 1/20 0.36
BCHE P06276 2/20 0.36
CTSA P10619 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
NOTUM Q6P988 1/20 0.35
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL1789498 0.89 ACHE (0.50) ACHEHDAC8HDAC4HDAC2RXRA
SCHEMBL1789565 0.83 GABRA1 (0.39) ACHEHDAC8RXRARXRBHDAC6
SCHEMBL1787675 0.82 ACHE (0.45) ACHEHDAC8HDAC4HDAC2RXRA
SCHEMBL1788079 0.81 IDO1 (0.45) ACHEHDAC8HDAC4HDAC2RXRA
SCHEMBL1789915 0.80 NR1H4 (0.41) ACHENPC1ALDH1A1RAB9AL3MBTL1
SCHEMBL1788537 0.78 ACHE (0.42) ACHEHDAC8HDAC4HDAC2RXRA
SCHEMBL1790838 0.77 MEN1 (0.35) ACHECES2CTSDBACE1NPC1
SCHEMBL1786832 0.75 MAPT (0.36) ACHERXRARXRBCTSDBACE1
SCHEMBL17449153 0.75 ACHE (0.50) ACHEHDAC8HDAC4HDAC2RXRA
SCHEMBL1787680 0.74 ACHE (0.44) ACHEHDAC8HDAC4HDAC2RXRA

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