SCHEMBL6276582

SCHEMBL6276582

CCCCCCCCCCCCCC(=O)OC(C)=O.CCCCCCCCCCCCCC(=O)OC(C)=O.CCCCCCCCCCCCCC(=O)OC(C)=O.[Al]

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.57
LMNA P02545 2/20 0.53
PAM P19021 2/20 0.52
CES2 O00748 3/20 0.50
CES1 P23141 3/20 0.50
MAPT P10636 2/20 0.50
MAPK1 P28482 1/20 0.50
PRKCA P17252 2/20 0.49
TSHR P16473 3/20 0.48
PPARG P37231 3/20 0.48
PPARD Q03181 3/20 0.48
PPARA Q07869 3/20 0.48
GPR84 Q9NQS5 2/20 0.48
HDAC11 Q96DB2 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
ALDH1A1 P00352 1/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
SLC22A8 Q8TCC7 1/20 0.48
TLR2 O60603 1/20 0.48
MEN1 O00255 1/20 0.48

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
SCHEMBL60795 0.98 DGKA (0.59) DGKALMNAPAMCES2CES1
SCHEMBL130890 0.98 DGKA (0.59) DGKALMNAPAMCES2CES1
SCHEMBL4631670 0.98 DGKA (0.59) DGKALMNAPAMCES2CES1
SCHEMBL8603407 0.98 DGKA (0.54) DGKALMNAPAMCES2CES1
SCHEMBL22126637 0.98 DGKA (0.59) DGKALMNAPAMCES2CES1
SCHEMBL627978 0.98 DGKA (0.59) DGKALMNAPAMCES2CES1
SCHEMBL2235744 0.98 DGKA (0.59) DGKALMNAPAMCES2CES1
SCHEMBL17222526 0.98 DGKA (0.59) DGKALMNAPAMCES2CES1
SCHEMBL1698285 0.98 DGKA (0.59) DGKALMNAPAMCES2CES1
SCHEMBL50589 0.98 DGKA (0.59) DGKALMNAPAMCES2CES1

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-6887398-B1 Aluminum acetoacetate compounds, the production and use thereof as printing ink additives RWE-DEA AKTIENGESELLSCHAFT FUR MINERALOEL UND CHEMIE (DE) 2005-05-03 US disclosed