SCHEMBL5054643

SCHEMBL5054643

NOC(=O)CCCOC(=O)CCCO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.41
HTR2C P28335 1/20 0.37
MGLL Q99685 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
CYP1A2 P05177 1/20 0.36
CAMK2A Q9UQM7 1/20 0.36
ADRA2A P08913 1/20 0.34
ADRA1A P35348 1/20 0.34
DNM1 Q05193 1/20 0.34
ALDH1A1 P00352 2/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPT P10636 2/20 0.33
BLM P54132 1/20 0.33
THRB P10828 1/20 0.33
CNR1 P21554 1/20 0.33

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
SCHEMBL11046376 0.87
SCHEMBL2160340 0.84 DGKA (0.48) DGKAHTR2CMGLLPRSS1PRSS2
SCHEMBL27535841 0.83 DGKA (0.50) DGKAHTR2CMGLLPRSS1PRSS2
SCHEMBL7725825 0.82 DGKA (0.46) DGKAHTR2CMGLLPRSS1PRSS2
SCHEMBL8533515 0.81 CAMK2A (0.61) DGKAMGLLCAMK2AALDH1A1TSHR
SCHEMBL1592226 0.80 DGKA (0.50) DGKAHTR2CMGLLPRSS1PRSS2
SCHEMBL13818881 0.80 MGLL (0.50) DGKAMGLLCYP1A2CAMK2AADRA2A
SCHEMBL7536494 0.80
SCHEMBL2353637 0.80 DGKA (0.48) DGKAHTR2CMGLLPRSS1PRSS2
SCHEMBL749774 0.80 DGKA (0.54) DGKAHTR2CMGLLPRSS1PRSS2

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
EP-1993565-A2 NUTRACEUTICAL COMPOSITIONS FROM MICROALGAE AND RELATED METHODS OF PRODUCTION AND ADMINISTRATION Solazyme, Inc. (US) 2008-11-26 EP disclosed
WO-2007136428-A2 NUTRACEUTICAL COMPOSITIONS FROM MICROALGAE AND RELATED METHODS OF PRODUCTION AND ADMINISTRATION SOLAZYME, INC. (US) 2007-11-29 WO disclosed