SCHEMBL24839338

SCHEMBL24839338

c1ccc(-n2c3ccccc3c3ccccc32)c(-c2nc(-c3ccccc3-n3c4ccccc4c4ccccc43)nc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 1/20 0.35
RAC2 P15153 1/20 0.33
RAC3 P60763 1/20 0.33
CDC42 P60953 1/20 0.33
RAC1 P63000 1/20 0.33
TDO2 P48775 3/20 0.31
IDO2 Q6ZQW0 3/20 0.31
IDO1 P14902 2/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
NTRK1 P04629 1/20 0.31
ALOX5 P09917 1/20 0.31
MAPT P10636 1/20 0.31
PTGS2 P35354 1/20 0.31
HTT P42858 1/20 0.31
MAPK8 P45983 1/20 0.31
RAB9A P51151 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
SCHEMBL22030402 0.97 KDM4E (0.39) KDM4EATML3MBTL1ALDH1A1RAC2
SCHEMBL22030978 0.97 KDM4E (0.39) KDM4EATML3MBTL1ALDH1A1RAC2
SCHEMBL20110564 0.96 KDM4E (0.42) KDM4EATML3MBTL1ALDH1A1RAC2
SCHEMBL17897512 0.89 L3MBTL1 (0.40) KDM4EATML3MBTL1ALDH1A1RAC2
SCHEMBL20110555 0.89 L3MBTL1 (0.40) KDM4EATML3MBTL1ALDH1A1RAC2
SCHEMBL20110532 0.89 L3MBTL1 (0.40) KDM4EATML3MBTL1ALDH1A1RAC2
SCHEMBL21430717 0.89 KDM4E (0.40) KDM4EATML3MBTL1ALDH1A1RAC2
SCHEMBL20110493 0.89 L3MBTL1 (0.40) KDM4EATML3MBTL1ALDH1A1RAC2
SCHEMBL24268890 0.88 ALDH1A1 (0.42) KDM4EATML3MBTL1ALDH1A1TDO2
SCHEMBL23039515 0.88 IDO1 (0.38) KDM4EATML3MBTL1IDO1

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-2023277645-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2023-01-05 WO disclosed