SCHEMBL3387724

SCHEMBL3387724

CC(O)OCC1CCOC1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.34
IRAK4 Q9NWZ3 2/20 0.34
MCHR1 Q99705 1/20 0.32
ACACB O00763 2/20 0.31
ACACA Q13085 1/20 0.31
GRM5 P41594 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
SCHEMBL3385920 0.89 SLC1A3 (0.30)
SCHEMBL3383772 0.88 PIK3CD (0.34) IRAK4ACACB
SCHEMBL21429865 0.84 IRAK4 (0.35) AOC3IRAK4MCHR1ACACBACACA
SCHEMBL12689563 0.84 IRAK4 (0.35) AOC3IRAK4MCHR1ACACBACACA
SCHEMBL26456430 0.81 MCHR1 (0.35) AOC3IRAK4MCHR1
SCHEMBL18787795 0.79 AOC3 (0.37) AOC3IRAK4ACACBACACAGRM5
SCHEMBL18787635 0.79 AOC3 (0.37) AOC3IRAK4ACACBACACAGRM5
SCHEMBL18787634 0.79 AOC3 (0.37) AOC3IRAK4ACACBACACAGRM5
SCHEMBL19812708 0.79 AOC3 (0.37) AOC3IRAK4ACACBACACAGRM5
SCHEMBL10958265 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010018132-A1 COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2010-02-18 WO disclosed