SCHEMBL22698398

SCHEMBL22698398

c1ccc(-c2nc(-c3ccccc3)nc(-c3cncc4oc5ccc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)cc5c34)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
HDAC4 P56524 1/20 0.33
PLA2G2A P14555 2/20 0.33
PLA2G4A P47712 2/20 0.33
CCNE2 O96020 1/20 0.32
CDK1 P06493 1/20 0.32
CCNB1 P14635 1/20 0.32
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32
GSK3B P49841 1/20 0.32
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32
BTK Q06187 2/20 0.31
PIK3CD O00329 1/20 0.31
PIK3R1 P27986 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
MTOR P42345 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
SCHEMBL17252964 0.95 KDM4E (0.36) L3MBTL1KDM4EATMPLA2G2APLA2G4A
SCHEMBL27340185 0.92 PTGER4 (0.34) L3MBTL1KDM4EATMCCNE2CDK1
SCHEMBL22698683 0.89 PTGER4 (0.35) L3MBTL1KDM4EPIK3CDPIK3CAPIK3CB
SCHEMBL29322978 0.89 PLA2G2A (0.37) L3MBTL1KDM4EATMHDAC4PLA2G2A
SCHEMBL22698273 0.88 PLA2G2A (0.38) L3MBTL1PLA2G2APLA2G4ACCNE2CDK1
SCHEMBL25023933 0.87 L3MBTL1 (0.37) L3MBTL1KDM4EATMHDAC4PLA2G2A
SCHEMBL25944400 0.87 PLA2G2A (0.36) L3MBTL1KDM4EATMHDAC4PLA2G2A
SCHEMBL17252528 0.87 PLA2G2A (0.36) L3MBTL1KDM4EATMHDAC4PLA2G2A
SCHEMBL22145856 0.87 PLA2G2A (0.36) L3MBTL1KDM4EATMHDAC4PLA2G2A
SCHEMBL22329764 0.86 L3MBTL1 (0.38) L3MBTL1KDM4EATMHDAC4PLA2G2A

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-2019212287-A9 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 (KR) 2020-11-26 WO disclosed