SCHEMBL1787910

SCHEMBL1787910

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.55
ATM Q13315 1/20 0.55
BCHE P06276 1/20 0.49
ELANE P08246 2/20 0.46
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 5/20 0.44
GAA P10253 2/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
NPSR1 Q6W5P4 1/20 0.41
NAMPT P43490 1/20 0.41
RBP4 P02753 3/20 0.40
TSHR P16473 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
P2RY1 P47900 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
SCHEMBL8402937 0.89 ELANE (0.46) TDP1ATMBCHEELANEALDH1A1
SCHEMBL30134334 0.89 TDP1 (0.62) TDP1ATMBCHEELANEALDH1A1
SCHEMBL47807 0.89 TDP1 (0.62) TDP1ATMBCHEELANEALDH1A1
SCHEMBL1790584 0.86 TDP1 (0.53) TDP1ATMBCHEELANEALDH1A1
SCHEMBL17923940 0.84 TDP1 (0.57) TDP1ATMBCHEALDH1A1KDM4E
SCHEMBL1790041 0.83 TDP1 (0.50) TDP1ATMBCHEALDH1A1KDM4E
SCHEMBL1788874 0.81 TDP1 (0.48) TDP1ATMBCHEALDH1A1KDM4E
SCHEMBL7863120 0.81 ELANE (0.43) TDP1ATMBCHEELANEALDH1A1
SCHEMBL27853484 0.81 TDP1 (0.72) TDP1ATMBCHEELANEALDH1A1
SCHEMBL247585 0.81 TDP1 (0.58) TDP1ATMBCHEELANEALDH1A1

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