SCHEMBL17812752

SCHEMBL17812752

CC(C)CCCCCCCCCCOC(=O)CCCC(=O)OCCCCCCCCCCC(C)C

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.48
NAAA Q02083 1/20 0.44
HTR2C P28335 1/20 0.43
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
NOD1 Q9Y239 1/20 0.42
MAPT P10636 1/20 0.42
RARB P10826 1/20 0.41
DNM1 Q05193 1/20 0.41
PLA2G2A P14555 2/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM4C Q9H3R0 2/20 0.39
KDM4A O75164 1/20 0.39
PHF8 Q9UPP1 1/20 0.39
KDM2A Q9Y2K7 1/20 0.39

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
SCHEMBL17812509 1.00 DGKA (0.48) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL517551 1.00 DGKA (0.48) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL632036 1.00 DGKA (0.48) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL916271 1.00 DGKA (0.48) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL17812616 1.00 DGKA (0.48) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL250064 1.00 DGKA (0.48) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL250394 1.00 DGKA (0.48) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL14674332 1.00 DGKA (0.48) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL17812523 1.00 DGKA (0.48) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL17812822 1.00 DGKA (0.48) DGKANAAAHTR2CPRSS1PRSS2

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-9365715-B2 Thermoplastic elastomer composition and method for the production thereof STYROLUTION EUROPE GMBH (DE) 2016-06-14 US disclosed