SCHEMBL20114175

SCHEMBL20114175

c1ccc(-c2ccc(-n3c4ccccc4c4ccc(-c5cccc(-c6ccc7c(c6)Sc6ccccc6N7c6ccccc6)c5)cc43)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.40
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
HDAC4 P56524 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
ALDH1A1 P00352 2/20 0.32
BCHE P06276 3/20 0.32
AVPR1A P37288 1/20 0.32
KMT2A Q03164 3/20 0.31
IL1R1 P14778 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
MEN1 O00255 2/20 0.30
PDE6D O43924 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
ACHE P22303 1/20 0.30
ADRA2A P08913 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30

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
SCHEMBL20114258 0.97 ATM (0.39) L3MBTL1KDM4EATMHDAC4HDAC6
SCHEMBL20114405 0.96 ATM (0.37) L3MBTL1KDM4EATMHDAC4HDAC6
SCHEMBL20114200 0.96 L3MBTL1 (0.40) L3MBTL1KDM4EATMHDAC4HDAC6
SCHEMBL20114188 0.94 KDM4E (0.35) L3MBTL1KDM4EATMHDAC4HDAC6
SCHEMBL20114198 0.93 ATM (0.37) L3MBTL1KDM4EATMHDAC4HDAC6
SCHEMBL14296798 0.93 L3MBTL1 (0.46) L3MBTL1KDM4EATMHDAC4HDAC6
SCHEMBL20114857 0.92 KDM4E (0.35) L3MBTL1KDM4EATMHDAC4HDAC6
SCHEMBL20114261 0.92 ATM (0.34) L3MBTL1KDM4EATMHDAC4HDAC6
SCHEMBL15470182 0.91 L3MBTL1 (0.42) L3MBTL1KDM4EATMHDAC4HDAC6
SCHEMBL20114042 0.91 L3MBTL1 (0.42) L3MBTL1KDM4EATMHDAC4HDAC6

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-2018080067-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING SAME 주식회사 두산 2018-05-03 WO disclosed