SCHEMBL22705753

SCHEMBL22705753

c1ccc(-c2cccc3ccc(-c4c5cccc(-c6cccc7c6c6ccccc6n7-c6ccccc6)c5cc5c(-c6cccc7c6c6ccccc6n7-c6ccccc6)cccc45)cc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
KMT2A Q03164 2/20 0.34
MCL1 Q07820 2/20 0.33
BAD Q92934 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
MAPK14 Q16539 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
TNF P01375 1/20 0.32
NTSR1 P30989 2/20 0.32
IL1R1 P14778 1/20 0.32
TLR4 O00206 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
ALK Q9UM73 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
SCHEMBL22706675 0.91 L3MBTL1 (0.38) L3MBTL1KDM4EATMKMT2AMCL1
SCHEMBL22705767 0.91 L3MBTL1 (0.38) L3MBTL1KDM4EATMKMT2AMCL1
SCHEMBL22706296 0.90 L3MBTL1 (0.41) L3MBTL1KDM4EATMKMT2AHDAC8
SCHEMBL22705756 0.90 L3MBTL1 (0.44) L3MBTL1KDM4EATMKMT2AMCL1
SCHEMBL22707261 0.88 L3MBTL1 (0.40) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL22706239 0.88 L3MBTL1 (0.40) L3MBTL1KDM4EATMKMT2AHDAC8
SCHEMBL22706329 0.88 L3MBTL1 (0.46) L3MBTL1KDM4EATMKMT2AMAPK14
SCHEMBL22705747 0.87 L3MBTL1 (0.42) L3MBTL1KDM4EATMKMT2AMCL1
SCHEMBL22706376 0.87 L3MBTL1 (0.39) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL22707016 0.87 L3MBTL1 (0.41) L3MBTL1KDM4EATMKMT2AIL1R1

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
US-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 US disclosed