SCHEMBL5819286

SCHEMBL5819286

CCCCCCCCCCCCCC(COc1ccccc1)C(C)=O

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 1/20 0.47
MTNR1A P48039 3/20 0.47
MTNR1B P49286 3/20 0.47
HDAC8 Q9BY41 4/20 0.46
HDAC3 O15379 2/20 0.46
HDAC6 Q9UBN7 2/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP12 P39900 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
FAAH O00519 6/20 0.45
PRSS1 P07477 1/20 0.45
PRSS2 P07478 1/20 0.45
PRSS3 P35030 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL10361086 0.88 TDP1 (0.55) PLA2G4BFAAHTDP1TP53TSHR
SCHEMBL3966237 0.88 ALOX5 (0.49) PLA2G4BMTNR1AMTNR1BMMP2MMP9
SCHEMBL4550642 0.83 ALOX5 (0.53) MTNR1AMTNR1BTDP1
SCHEMBL26456912 0.81 PLA2G4B (0.55) PLA2G4BMMP2MMP9MMP12PRSS1
SCHEMBL13431025 0.80 ALDH1A1 (0.48) PLA2G4BMTNR1AMTNR1BMMP2MMP9
SCHEMBL15514507 0.79 ALOX5 (0.53) PLA2G4BFAAHTDP1TP53TSHR
SCHEMBL6231558 0.78 PLA2G4B (0.55) PLA2G4BTSHR
SCHEMBL9797717 0.78 PLA2G4B (0.55) PLA2G4BTSHR
SCHEMBL9797915 0.78 PLA2G4B (0.55) PLA2G4BTSHR
SCHEMBL10451366 0.78 LTA4H (0.49) PLA2G4BFAAHPRSS1PRSS2PRSS3

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
WO-2006090072-A1 PPAR ACTIVATOR DERIVATIVES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS NEGMA-LERADS (FR) 2006-08-31 WO disclosed