SCHEMBL9719950

SCHEMBL9719950

O=C1C=CC(=O)N1c1ccccc1-c1ccc(-c2ccccc2N2C(=O)C=CC2=O)cc1

nearest known ligand 0.88

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 13/20 0.88
TLR9 Q9NR96 2/20 0.67
FAAH O00519 4/20 0.50
NR1H2 P55055 1/20 0.49
ALDH1A1 P00352 5/20 0.46
NPSR1 Q6W5P4 2/20 0.46
HSP90AA1 P07900 2/20 0.46
PKM P14618 2/20 0.46
ATM Q13315 2/20 0.46
CCR6 P51684 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HTT P42858 2/20 0.45
HSD17B10 Q99714 1/20 0.45
CES2 O00748 1/20 0.42
BCHE P06276 1/20 0.42
GAA P10253 1/20 0.42
CES1 P23141 1/20 0.42

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
SCHEMBL30398083 0.94 MGLL (1.00) MGLLTLR9FAAHNR1H2ALDH1A1
SCHEMBL3768557 0.94 MGLL (1.00) MGLLTLR9FAAHNR1H2ALDH1A1
SCHEMBL2900895 0.91 MGLL (0.73) MGLLTLR9FAAHNR1H2ALDH1A1
SCHEMBL6832688 0.89 TLR9 (0.76) MGLLTLR9FAAHALDH1A1NPSR1
SCHEMBL28616908 0.86 MGLL (0.73) MGLLTLR9FAAHALDH1A1NPSR1
SCHEMBL8995930 0.86 MGLL (0.72) MGLLTLR9FAAHNR1H2ALDH1A1
SCHEMBL29377102 0.81 TLR9 (1.00) MGLLTLR9FAAHALDH1A1NPSR1
SCHEMBL121404 0.81 TLR9 (1.00) MGLLTLR9FAAHALDH1A1NPSR1
SCHEMBL28624878 0.79 MGLL (0.73) MGLLTLR9FAAHNR1H2ALDH1A1
SCHEMBL28619051 0.78 MGLL (0.73) MGLLFAAHALDH1A1NPSR1HSP90AA1

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
EP-0471522-A1 Resin composition based on polymaleimide and phenolic aralkyl resin MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-02-19 EP disclosed