SCHEMBL1789571

SCHEMBL1789571

CC(OC(=O)Oc1ccccc1C(C)(C)C)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
HCAR2 Q8TDS4 1/20 0.44
BCHE P06276 1/20 0.43
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.42
GAA P10253 1/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
HSD17B10 Q99714 2/20 0.40
HPGD P15428 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
RBP4 P02753 3/20 0.38
RORC P51449 2/20 0.36
NAMPT P43490 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL1788922 0.86 HCAR2 (0.42) ATMTDP1HCAR2KDM4EALDH1A1
SCHEMBL1788853 0.82 TDP1 (0.50) ATMTDP1BCHEKDM4EALDH1A1
SCHEMBL30134334 0.81 TDP1 (0.62) ATMTDP1BCHEKDM4EALDH1A1
SCHEMBL47807 0.81 TDP1 (0.62) ATMTDP1BCHEKDM4EALDH1A1
SCHEMBL1840850 0.80 HCAR2 (0.47) ATMTDP1HCAR2BCHEKDM4E
SCHEMBL1787562 0.79 TDP1 (0.48) ATMTDP1BCHEKDM4EALDH1A1
SCHEMBL17923940 0.79 TDP1 (0.57) ATMTDP1BCHEKDM4EALDH1A1
SCHEMBL1837748 0.78 POLB (0.46) HCAR2KDM4EALDH1A1GAAHSD17B10
SCHEMBL1840197 0.78 HCAR2 (0.45) HCAR2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL3786370 0.77 HCAR2 (0.61) HCAR2ALDH1A1HSD17B10RORCTP53

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