SCHEMBL24949540

SCHEMBL24949540

Clc1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2-c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CYP1A2 P05177 1/20 0.41
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
MAP4K4 O95819 1/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 2/20 0.37
GLA P06280 1/20 0.37
MAPK14 Q16539 1/20 0.37
MAPT P10636 1/20 0.37
MDM2 Q00987 2/20 0.36
ADORA2B P29275 1/20 0.36
ADORA1 P30542 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL24947187 1.00 KDM4E (0.46) KDM4EATML3MBTL1CYP1A2ALDH1A1
SCHEMBL30257576 0.91 KDM4E (0.43) KDM4EATML3MBTL1CYP1A2MAPK14
SCHEMBL26148648 0.91 L3MBTL1 (0.50) KDM4EATML3MBTL1CYP1A2NPC1
SCHEMBL24949671 0.91 KDM4E (0.38) KDM4EATML3MBTL1CYP1A2ALDH1A1
SCHEMBL24948417 0.91 KDM4E (0.38) KDM4EATML3MBTL1CYP1A2ALDH1A1
SCHEMBL26763733 0.91 L3MBTL1 (0.57) KDM4EATML3MBTL1ALDH1A1HTT
SCHEMBL13100576 0.89 L3MBTL1 (0.55) KDM4EATML3MBTL1ALDH1A1HTT
SCHEMBL20865046 0.88 L3MBTL1 (0.53) KDM4EATML3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL14429642 0.87 L3MBTL1 (0.55) KDM4EATML3MBTL1CYP1A2ALDH1A1
SCHEMBL65354 0.87 L3MBTL1 (0.55) KDM4EATML3MBTL1ALDH1A1HTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023002447-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed
WO-2023003403-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed