SCHEMBL6009539

SCHEMBL6009539

CCCCC(CC(F)(F)F)OC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.38
CA1 P00915 2/20 0.38
MAPK1 P28482 2/20 0.37
MAPT P10636 2/20 0.35
PRKCA P17252 1/20 0.35
PRKCD Q05655 1/20 0.35
CTSK P43235 2/20 0.34
ACHE P22303 1/20 0.34
BACE1 P56817 1/20 0.34
FAAH O00519 5/20 0.33
CES2 O00748 2/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
CES1 P23141 3/20 0.32
GPR84 Q9NQS5 2/20 0.32

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
SCHEMBL608946 0.89 CHRM1 (0.35) PRKCAPRKCDCTSK
SCHEMBL6009537 0.87 CA2 (0.39) CA2CA1MAPK1MAPTPRKCA
SCHEMBL1837070 0.82 CA2 (0.46) CA2CA1MAPK1MAPTPRKCA
SCHEMBL611379 0.81 HTT (0.30)
SCHEMBL610760 0.80 HTT (0.34)
SCHEMBL31674482 0.79 MAPT (0.37) CA2CA1MAPK1MAPTFAAH
SCHEMBL608475 0.79 PRKCA (0.50) CA2CA1MAPK1PRKCAPRKCD
SCHEMBL1835395 0.79 GPR84 (0.47) CA2CA1MAPK1MAPTCTSK
SCHEMBL1836821 0.79 CTSK (0.50) CA2CA1MAPK1MAPTPRKCA
SCHEMBL1395519 0.79 GPR84 (0.40) CA2CA1MAPK1MAPTSLC1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6984471-B2 Nonaqueous electrolyte and nonaqueous electrolyte battery SONY CORPORATION (JP) 2006-01-10 US disclosed
US-20030087160-A1 Nonaqueous electrolyte and nonaqueous electrolyte battery MURATA MANUFACTURING CO., LTD. (JP) 2003-05-08 US disclosed