SCHEMBL783630

SCHEMBL783630

CCOC(OCC)(OCC)OC(=O)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
CES2 O00748 4/20 0.32
FAAH O00519 8/20 0.31
CES1 P23141 5/20 0.30
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30

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
SCHEMBL784817 0.83 CES2 (0.36) CES2FAAHCES1MEN1CYP1A2
SCHEMBL784636 0.77
SCHEMBL783715 0.73 ALDH1A1 (0.43) HSD17B10
SCHEMBL784066 0.73 DGAT1 (0.31)
SCHEMBL784015 0.71 ALDH1A1 (0.35) HSD17B10
SCHEMBL783608 0.71 ALDH1A1 (0.33) HSD17B10
SCHEMBL27889607 0.70 ALDH1A1 (0.48) HDAC4HDAC6MEN1KMT2AHSD17B10
SCHEMBL60813 0.70
SCHEMBL12590813 0.70 ALDH1A1 (0.36) HDAC4HDAC6CES2FAAHCES1
SCHEMBL25271339 0.69 ALDH1A1 (0.46) HDAC4HDAC6MEN1KMT2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102412416-A Nonaqueous electrolyte and nonaqueous electrolyte battery SONY CORP 2012-04-11 CN disclosed
US-20120070730-A1 NONAQUEOUS ELECTROLYTE AND NONAQUEOUS ELECTROLYTE BATTERY SONY CORPORATION (JP) 2012-03-22 US disclosed
US-20120070730-A1 NONAQUEOUS ELECTROLYTE AND NONAQUEOUS ELECTROLYTE BATTERY SONY CORPORATION (JP) 2012-03-22 US disclosed