SCHEMBL2992948

SCHEMBL2992948

CCOC(=O)CC(CC(F)(F)F)(CC(F)(F)F)P(=O)(O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.38
MGAM O43451 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
ALDH1A1 P00352 4/20 0.35
TRPA1 O75762 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
LPAR1 Q92633 1/20 0.33
LPAR3 Q9UBY5 1/20 0.33
POLB P06746 2/20 0.33
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
CYP1A2 P05177 1/20 0.32
PTPN2 P17706 2/20 0.32
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL2987515 0.87 LPAR1 (0.35) ALDH1A1LPAR1LPAR3
SCHEMBL2986148 0.84 LPAR1 (0.40) ALDH1A1LPAR1LPAR3TSHR
SCHEMBL2976317 0.82 TSHR (0.33) GAAMGAMSIMGAM2TSHR
SCHEMBL2239061 0.82 HTT (0.34) SMN1; SMN2NPC1RAB9ALPAR1LPAR3
SCHEMBL710886 0.82 GAA (0.43) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL2235500 0.80 LPAR1 (0.36) LPAR1LPAR3
SCHEMBL2983889 0.79 FDPS (0.41) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL2239270 0.77 LPAR1 (0.41) LPAR1LPAR3
SCHEMBL2238386 0.76 FDPS (0.38) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL27758955 0.76 FDPS (0.43) GAAMGAMSIMGAM2LPAR1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2237358-B1 Nonaqueous electrolyte battery MITSUBISHI CHEM CORP (JP) 2015-08-12 EP disclosed
US-9005824-B2 Lithium secondary battery HITACHI MAXELL, LTD. (JP) 2015-04-14 US disclosed
US-8962192-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2015-02-24 US disclosed
US-20130344381-A1 LITHIUM SECONDARY BATTERY MAXELL, LTD. (JP) 2013-12-26 US disclosed
US-8574757-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2013-11-05 US disclosed
EP-2128923-B1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEM CORP (JP) 2013-01-16 EP disclosed
US-20120264011-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-10-18 US disclosed
US-20120156557-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-06-21 US disclosed
EP-2237358-A1 Nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2010-10-06 EP disclosed
US-20100035147-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2010-02-11 US disclosed
EP-2128923-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY Mitsubishi Chemical Corporation (JP) 2009-12-02 EP disclosed