SCHEMBL15280932

SCHEMBL15280932

c1ccc2c(c1)c1ccccc1n2-c1ccc(CC(Cc2ccc(-n3c4ccccc4c4cnccc43)cc2)(Cc2ccc(-n3c4ccccc4c4ncccc43)cc2)Cc2ccc(-n3c4ccccc4c4ncccc43)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.41
MAOB P27338 4/20 0.41
ACHE P22303 2/20 0.41
HDAC2 Q92769 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
HDAC3 O15379 1/20 0.39
CYP2D6 P10635 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GUSB P08236 1/20 0.32
MKNK1 Q9BUB5 1/20 0.32
MKNK2 Q9HBH9 1/20 0.32
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
REN P00797 1/20 0.31
NAMPT P43490 1/20 0.31
PDE10A Q9Y233 1/20 0.31

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
SCHEMBL261856 0.90 KDM4E (0.40) CYP2D6KDM4EATML3MBTL1REN
SCHEMBL261947 0.90 MAOA (0.49) MAOAMAOBACHEHDAC2HDAC6
SCHEMBL17264915 0.84 MAOA (0.41) MAOAMAOBACHECYP2D6KDM4E
SCHEMBL261853 0.83 MAOA (0.37) MAOAMAOBACHEHDAC2HDAC6
SCHEMBL13811431 0.82 MAOA (0.46) MAOAMAOBACHECYP2D6KDM4E
SCHEMBL13811428 0.82 MAOA (0.39) MAOAMAOBACHEHDAC2HDAC6
SCHEMBL19764712 0.82 MAOA (0.40) MAOAMAOBACHECYP2D6KDM4E
SCHEMBL13697551 0.82 MAOA (0.41) MAOAMAOBACHEHDAC2HDAC6
SCHEMBL21610893 0.81 MAOA (0.43) MAOAMAOBACHECYP2D6KDM4E
SCHEMBL261898 0.79 MAOA (0.43) MAOAMAOBACHECYP2D6KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130252027-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE AND ILLUMINATING DEVICE Konica Minolta, Inc. (JP) 2013-09-26 US disclosed
US-20130252027-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE AND ILLUMINATING DEVICE Konica Minolta, Inc. (JP) 2013-09-26 US disclosed