SCHEMBL25904282

SCHEMBL25904282

N#Cc1cccc(-c2cc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)c(C#N)c(-n3c4ccccc4c4c5c(c6ccccc6n5-c5ccccc5)c5c(c6ccccc6n5-c5ccccc5)c43)c2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ADORA2A P29274 4/20 0.35
ADORA1 P30542 4/20 0.35
ADORA2B P29275 3/20 0.33
PGR P06401 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
ALDH1A1 P00352 4/20 0.33
LMNA P02545 4/20 0.33
ALDH1A3 P47895 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP1A2 P05177 5/20 0.32
CYP3A4 P08684 4/20 0.32
MEN1 O00255 3/20 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
SCHEMBL25904271 0.93 KDM4E (0.38) KDM4EATML3MBTL1PGRALDH1A1
SCHEMBL25903669 0.92 KDM4E (0.35) KDM4EATML3MBTL1ADORA2AADORA1
SCHEMBL25904267 0.91 KDM4E (0.43) KDM4EATML3MBTL1ALDH1A1LMNA
SCHEMBL25903792 0.91 KDM4E (0.35) KDM4EATML3MBTL1ADORA2AADORA1
SCHEMBL25904280 0.90 KDM4E (0.42) KDM4EATML3MBTL1ALDH1A1LMNA
SCHEMBL25903340 0.90 KDM4E (0.36) KDM4EATML3MBTL1ADORA2AADORA1
SCHEMBL25904288 0.89 KDM4E (0.39) KDM4EATML3MBTL1PGRGABRA1
SCHEMBL25903074 0.89 KDM4E (0.37) KDM4EATML3MBTL1ADORA2AADORA1
SCHEMBL21546486 0.88 KDM4E (0.42) KDM4EATML3MBTL1ADORA2AADORA1
SCHEMBL25904528 0.87 KDM4E (0.40) KDM4EATML3MBTL1ADORA2AADORA1

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-2023140706-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-27 WO disclosed