SCHEMBL22706385

SCHEMBL22706385

c1ccc(-n2c3ccccc3c3cc(-c4cccc5c(-c6ccc7cc8ccccc8cc7c6)c6cccc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)c6cc45)ccc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ALOX5 P09917 1/20 0.35
PTGER4 P35408 1/20 0.34
HDAC4 P56524 2/20 0.33
GPR84 Q9NQS5 1/20 0.33
KMT2A Q03164 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
MET P08581 1/20 0.33
MCL1 Q07820 1/20 0.33
ACMSD Q8TDX5 1/20 0.33
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32
TUBA4A P68366 1/20 0.32
TUBB4B P68371 1/20 0.32
TUBB3 Q13509 1/20 0.32

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
SCHEMBL22705680 0.96 KDM4E (0.45) KDM4EATML3MBTL1ALOX5PTGER4
SCHEMBL22707755 0.94 KDM4E (0.45) KDM4EATML3MBTL1ALOX5PTGER4
SCHEMBL22707262 0.93 L3MBTL1 (0.44) KDM4EATML3MBTL1PTGER4HDAC4
SCHEMBL22706590 0.92 KDM4E (0.38) KDM4EATML3MBTL1ALOX5PTGER4
SCHEMBL22707469 0.92 L3MBTL1 (0.43) KDM4EATML3MBTL1PTGER4HDAC4
SCHEMBL22705756 0.90 L3MBTL1 (0.44) KDM4EATML3MBTL1ALOX5PTGER4
SCHEMBL22708160 0.90 KDM4E (0.44) KDM4EATML3MBTL1ALOX5HDAC4
SCHEMBL22705874 0.90 L3MBTL1 (0.46) KDM4EATML3MBTL1ALOX5PTGER4
SCHEMBL22706591 0.89 KDM4E (0.43) KDM4EATML3MBTL1ALOX5PTGER4
SCHEMBL22706418 0.89 L3MBTL1 (0.50) KDM4EATML3MBTL1PTGER4HDAC4

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