SCHEMBL784662

SCHEMBL784662

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

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.43
ALDH1A1 P00352 3/20 0.35
LMNA P02545 2/20 0.33
HSD17B10 Q99714 1/20 0.33
ALOX15 P16050 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
SOAT1 P35610 1/20 0.32
CES2 O00748 1/20 0.30
TRPA1 O75762 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
SCHEMBL783724 0.83 CES2 (0.32) ALDH1A1CES2
SCHEMBL662137 0.73 THRB (0.50) THRBALDH1A1LMNAHSD17B10ALOX15
SCHEMBL784663 0.73
SCHEMBL238384 0.72
SCHEMBL783625 0.71 THRB (0.48) THRBALDH1A1LMNAHSD17B10MGAM
SCHEMBL783599 0.71 THRB (0.42) THRB
Bromide SCHEMBL31026184 0.70
SCHEMBL9936874 0.70 LMNA (0.33) ALDH1A1LMNAHSD17B10ALOX15MGAM
SCHEMBL17501746 0.69 THRB (0.50) THRBALDH1A1LMNAHSD17B10ALOX15
SCHEMBL9937321 0.68 ALDH1A1 (0.33) ALDH1A1LMNAHSD17B10

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