SCHEMBL10066604

SCHEMBL10066604

CCCCCCCCC(CC(=O)OCCOCCC)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.45
GRIK2 Q13002 2/20 0.45
DGKA P23743 1/20 0.45
SLC1A2 P43004 1/20 0.43
SLC1A1 P43005 1/20 0.43
CA2 P00918 2/20 0.42
MAPK1 P28482 1/20 0.42
GPR84 Q9NQS5 7/20 0.41
NAAA Q02083 1/20 0.41
FFAR1 O14842 1/20 0.41
MAPT P10636 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40

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
SCHEMBL10066601 0.91 GRIK1 (0.50) GRIK1GRIK2DGKASLC1A2SLC1A1
SCHEMBL14232270 0.88 DNM1 (0.43) GRIK1GRIK2DGKASLC1A2SLC1A1
SCHEMBL27489586 0.88 NAAA (0.55) GRIK1GRIK2DGKASLC1A2SLC1A1
SCHEMBL15255502 0.87 GRIK1 (0.46) GRIK1GRIK2DGKASLC1A2SLC1A1
SCHEMBL27578440 0.86 NAAA (0.53) GRIK1GRIK2DGKASLC1A2SLC1A1
SCHEMBL5076042 0.83 DGKA (0.49) DGKAGPR84NAAA
SCHEMBL5076593 0.83 DGKA (0.49) DGKAGPR84NAAA
SCHEMBL5079180 0.83 DGKA (0.49) DGKAGPR84NAAA
SCHEMBL5076019 0.83 DGKA (0.49) DGKAGPR84NAAA
SCHEMBL7213826 0.83 GRIK1 (0.51) GRIK1GRIK2SLC1A2SLC1A1CA2

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
US-8138222-B2 Whitening agents for cellulosic substrates MILLIKEN & COMPANY (US) 2012-03-20 US disclosed