SCHEMBL1789699

SCHEMBL1789699

CCC(OC(=O)OC(CC)c1ccccc1F)c1ccccc1F

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
CYP3A4 P08684 1/20 0.41
IDO1 P14902 1/20 0.41
TDO2 P48775 1/20 0.41
CNR2 P34972 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MC4R P32245 5/20 0.39
LMNA P02545 3/20 0.39
KCNQ2 O43526 1/20 0.39
GAA P10253 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KDM4E B2RXH2 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
SCHEMBL1792456 0.84 IDO1 (0.40) CES2CES1CYP3A4IDO1TDO2
SCHEMBL1790143 0.77 TSHR (0.36) CYP3A4KMT2AGAAALDH1A1KDM4E
SCHEMBL7984628 0.75 IDO1 (0.40) CES2CES1CYP3A4IDO1TDO2
SCHEMBL983637 0.74 LMNA (0.47) CYP3A4MEN1KMT2ALMNAGAA
SCHEMBL31287461 0.72 MEN1 (0.41) IDO1TDO2CNR2MEN1KMT2A
SCHEMBL1788624 0.71 ALDH1A1 (0.42) LMNAALDH1A1
SCHEMBL9587796 0.71 KCNQ2 (0.49) CES2CES1CYP3A4CNR2MEN1
SCHEMBL30427742 0.71 KCNQ2 (0.49) CES2CES1CNR2MC4RLMNA
SCHEMBL1966206 0.71 KCNQ2 (0.49) CES2CES1CNR2MC4RLMNA
SCHEMBL9159786 0.71 CNR2 (0.42) CES2CES1CYP3A4CNR2MEN1

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