SCHEMBL5017279

SCHEMBL5017279

CCCCCCCCCCCCCC(CCCCCCCC)C(=O)CC

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.57
GPR84 Q9NQS5 7/20 0.50
GRIK1 P39086 2/20 0.50
GRIK2 Q13002 2/20 0.50
FFAR1 O14842 1/20 0.50
MAPT P10636 1/20 0.48
LCK P06239 1/20 0.48
PPARD Q03181 1/20 0.48
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48
SLC1A2 P43004 1/20 0.47
SLC1A1 P43005 1/20 0.47
MAPK1 P28482 1/20 0.46
FFAR4 Q5NUL3 1/20 0.45
ACE2 Q9BYF1 1/20 0.45

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
SCHEMBL16564592 1.00 CA2 (0.57) CA2GPR84GRIK1GRIK2FFAR1
SCHEMBL1423123 1.00 CA2 (0.57) CA2GPR84GRIK1GRIK2FFAR1
SCHEMBL18994621 1.00 CA2 (0.57) CA2GPR84GRIK1GRIK2FFAR1
SCHEMBL5017533 1.00 CA2 (0.57) CA2GPR84GRIK1GRIK2FFAR1
SCHEMBL1408172 1.00 CA2 (0.57) CA2GPR84GRIK1GRIK2FFAR1
SCHEMBL5023871 1.00 CA2 (0.57) CA2GPR84GRIK1GRIK2FFAR1
SCHEMBL18994619 1.00 CA2 (0.57) CA2GPR84GRIK1GRIK2FFAR1
SCHEMBL9356717 1.00 CA2 (0.57) CA2GPR84GRIK1GRIK2FFAR1
SCHEMBL18869001 1.00 CA2 (0.57) CA2GPR84GRIK1GRIK2FFAR1
SCHEMBL688312 0.98 CA2 (0.61) CA2GPR84GRIK1GRIK2FFAR1

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
EP-1585741-B1 CYCLIC KETONE PEROXIDE FORMULATIONS AKZO NOBEL NV (NL) 2008-10-01 EP claimed