SCHEMBL1787900

SCHEMBL1787900

CC(C)(C)c1cc(C(C)(C)C)c(C(C)(C)C)cc1COC(=O)OCc1cc(C(C)(C)C)c(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLRA3 O75311 1/20 0.37
GLRB P48167 1/20 0.37
GAA P10253 3/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
ALDH1A1 P00352 4/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALOX15 P16050 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP1A2 P05177 1/20 0.32
ATP2A2 P16615 1/20 0.32
ATP2A3 Q93084 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
LMNA P02545 2/20 0.32
RECQL P46063 1/20 0.32
HSPA5 P11021 1/20 0.32
CYP2C9 P11712 2/20 0.31
NR1I2 O75469 1/20 0.31
MIF P14174 1/20 0.31

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
SCHEMBL1787901 0.87 GLRA3 (0.40) GLRA3GLRBGAAMRGPRX4ALDH1A1
SCHEMBL18585648 0.86 GLRA3 (0.33) GLRA3GLRBGAAALDH1A1TDP1
SCHEMBL1788156 0.81 GAA (0.40) GLRA3GLRBGAAMRGPRX4ALDH1A1
SCHEMBL28413275 0.81 ALDH1A1 (0.41) ALDH1A1TDP1SMN1; SMN2MAPTKDM4E
SCHEMBL10495884 0.80 ALDH1A1 (0.48) GAAALDH1A1ALOX15SMN1; SMN2CYP1A2
SCHEMBL1788891 0.79 GAA (0.38) GLRA3GLRBGAAALDH1A1TDP1
SCHEMBL2974511 0.78 ALDH1A1 (0.40) ALDH1A1TDP1ALOX15SMN1; SMN2KDM4E
SCHEMBL28552616 0.78 IDO1 (0.45) ALDH1A1ALOX15SMN1; SMN2MAPTHTT
SCHEMBL1793184 0.76 GAA (0.36) GLRA3GLRBGAATDP1
SCHEMBL1787508 0.76 RXRA (0.42) GAAALDH1A1TDP1MAPTKDM4E

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