SCHEMBL28060765

SCHEMBL28060765

CCCCCCCC/C=C\CCCCCCCCc1cc(C(N)=O)cc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 3/20 0.46
F3 P13726 3/20 0.46
KDM4E B2RXH2 3/20 0.46
MMP2 P08253 2/20 0.46
MAPT P10636 2/20 0.46
ALOX15 P16050 1/20 0.46
ECE1 P42892 1/20 0.46
SGMS1 Q86VZ5 1/20 0.46
SGMS2 Q8NHU3 1/20 0.46
MUS81 Q96NY9 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SAE1 Q9UBE0 1/20 0.46
BID P55957 3/20 0.44
BCL2L1 Q07817 3/20 0.44
MCL1 Q07820 3/20 0.44
BAK1 Q16611 3/20 0.44
FAAH O00519 3/20 0.42
EPHX2 P34913 1/20 0.42
SOAT1 P35610 3/20 0.42
PPARA Q07869 1/20 0.41

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
SCHEMBL28060768 0.81 FAAH (0.47) KDM4EFAAHEPHX2SOAT1MEN1
SCHEMBL27760654 0.81 MAPT (0.48) KDM4EMAPTHSD17B10SAE1BID
SCHEMBL5968378 0.76 MAPT (0.46) F7F3KDM4EMMP2MAPT
SCHEMBL25383768 0.76 F7 (0.56) F7F3KDM4EMMP2MAPT
SCHEMBL27782246 0.75 DHODH (0.43) KDM4EHSD17B10MEN1CYP1A2CYP2C19
SCHEMBL28835732 0.73 TLR8 (0.47) KDM4EMAPTHSD17B10SAE1BID
Ammonia Solution, Strong SCHEMBL27919173 0.72 MAPT (0.49) KDM4EMAPTALOX15HSD17B10MEN1
SCHEMBL11873292 0.72 MAPT (0.52) KDM4EMAPTALOX15HSD17B10MEN1
Ammonia Solution, Strong SCHEMBL27919149 0.72 MAPT (0.49) KDM4EMAPTALOX15HSD17B10MEN1
SCHEMBL29120679 0.72 ALOX5 (0.50) KDM4EMAPTALOX15HSD17B10MEN1

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
CN-105378554-A Colored electrophoretic displays E INK CORP 2016-03-02 CN disclosed