SCHEMBL25007718

SCHEMBL25007718

c1ccc(-c2ccc3oc4ccc5c(c4c3c2)NC(c2ccc(-n3c4ccccc4c4ccccc43)cc2)O5)cc1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.37
PLA2G2A P14555 3/20 0.34
PLA2G4A P47712 3/20 0.34
KDM4E B2RXH2 2/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
PLA2G10 O15496 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
SCHEMBL25007506 0.91 CYP1A1 (0.33) HDAC4PLA2G2APLA2G4A
SCHEMBL24546842 0.86 HDAC4 (0.31) HDAC4KDM4EATML3MBTL1
SCHEMBL25007924 0.82 HDAC4 (0.35) HDAC4KDM4EATML3MBTL1MEN1
SCHEMBL25008254 0.80 HDAC4 (0.37) HDAC4PLA2G2APLA2G4AKDM4EATM
SCHEMBL16500998 0.78 KDM4E (0.52) HDAC4PLA2G2APLA2G4AKDM4EATM
SCHEMBL9890564 0.77 KDM4E (0.43) HDAC4PLA2G2APLA2G4AKDM4EATM
SCHEMBL9890531 0.77 KDM4E (0.43) HDAC4PLA2G2APLA2G4AKDM4EATM
SCHEMBL24676334 0.76 KDM4E (0.44) HDAC4PLA2G2APLA2G4AKDM4EATM
SCHEMBL9890541 0.75 KDM4E (0.42) HDAC4PLA2G2APLA2G4AKDM4EATM
SCHEMBL9889808 0.75 L3MBTL1 (0.50) HDAC4PLA2G2APLA2G4AKDM4EATM

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-2023012711-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-02-09 WO disclosed