SCHEMBL16613798

SCHEMBL16613798

c1ccc(-c2ccc(-n3c4ccccc4c4ccc5c(ccn5-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c43)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
HDAC4 P56524 1/20 0.34
MAOB P27338 1/20 0.33
AKR1C4 P17516 1/20 0.32
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
AKR1C1 Q04828 1/20 0.32
HTR7 P34969 1/20 0.32
KMT2A Q03164 2/20 0.32
IL1R1 P14778 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
WNK1 Q9H4A3 1/20 0.31
EDNRB P24530 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
SCHEMBL15632270 1.00 L3MBTL1 (0.39) L3MBTL1KDM4EATMHDAC4MAOB
SCHEMBL17015784 0.97 L3MBTL1 (0.42) L3MBTL1KDM4EATMHDAC4MAOB
SCHEMBL16613857 0.96 L3MBTL1 (0.44) L3MBTL1KDM4EATMHDAC4MAOB
SCHEMBL17015783 0.95 KDM4E (0.39) L3MBTL1KDM4EATMHDAC4MAOB
SCHEMBL17015728 0.95 KDM4E (0.36) L3MBTL1KDM4EATMHDAC4MAOB
SCHEMBL17015723 0.95 KDM4E (0.36) L3MBTL1KDM4EATMHDAC4MAOB
SCHEMBL17015780 0.95 KDM4E (0.39) L3MBTL1KDM4EATMHDAC4MAOB
SCHEMBL17015786 0.95 KDM4E (0.39) L3MBTL1KDM4EATMHDAC4MAOB
SCHEMBL17015746 0.95 KDM4E (0.36) L3MBTL1KDM4EATMHDAC4MAOB
SCHEMBL20427165 0.95 L3MBTL1 (0.42) L3MBTL1KDM4EATMHDAC4MAOB

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-2015046981-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed