SCHEMBL24765783

SCHEMBL24765783

c1ccc(-n2c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cccc6sc7ccccc7c56)cc4)cc3c3cc4ccccc4cc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALK Q9UM73 1/20 0.33
PTGER4 P35408 1/20 0.32
BRDT Q58F21 1/20 0.31
HSD17B10 Q99714 1/20 0.31
S1PR4 O95977 2/20 0.31
S1PR5 Q9H228 2/20 0.31
PDE1B Q01064 1/20 0.31
PDE3A Q14432 1/20 0.31
PDE11A Q9HCR9 1/20 0.31
HDAC4 P56524 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
SCHEMBL17228923 0.96 KDM4E (0.40) KDM4EATML3MBTL1ALKBRDT
SCHEMBL24765784 0.94 KDM4E (0.37) KDM4EATML3MBTL1PTGER4BRDT
SCHEMBL16545691 0.93 ATM (0.44) KDM4EATML3MBTL1ALKPTGER4
SCHEMBL16804081 0.92 ATM (0.43) KDM4EATML3MBTL1ALKPTGER4
SCHEMBL16804098 0.91 KDM4E (0.40) KDM4EATML3MBTL1ALKPTGER4
SCHEMBL18779535 0.91 S1PR5 (0.38) KDM4EATML3MBTL1ALKPTGER4
SCHEMBL17178507 0.91 S1PR5 (0.38) KDM4EATML3MBTL1ALKPTGER4
SCHEMBL17178961 0.91 KDM4E (0.38) KDM4EATML3MBTL1PTGER4BRDT
SCHEMBL18779522 0.91 KDM4E (0.38) KDM4EATML3MBTL1PTGER4BRDT
SCHEMBL24304102 0.90 PMM2 (0.35) KDM4EATML3MBTL1ALKBRDT

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-2022260443-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2022-12-15 WO disclosed