SCHEMBL23505151

SCHEMBL23505151

c1ccc(-c2cccc(-c3ccc4c(c3)sc3ccc(-n5c6ccccc6c6ccccc65)cc34)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LIMK1 P53667 2/20 0.35
HDAC4 P56524 1/20 0.35
PIM3 Q86V86 1/20 0.34
GPR3 P46089 1/20 0.33
F9 P00740 2/20 0.33
MCL1 Q07820 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
PIK3CA P42336 1/20 0.32
PI4KA P42356 1/20 0.32
PI4KB Q9UBF8 1/20 0.32
CYP1A2 P05177 1/20 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
SCHEMBL26514880 0.94 KDM4E (0.39) KDM4EATML3MBTL1ALDH1A1MAPT
SCHEMBL9890248 0.93 L3MBTL1 (0.41) KDM4EATML3MBTL1ALDH1A1MAPT
SCHEMBL17228717 0.93 L3MBTL1 (0.43) KDM4EATML3MBTL1ALDH1A1MAPT
SCHEMBL17228706 0.93 L3MBTL1 (0.43) KDM4EATML3MBTL1ALDH1A1MAPT
SCHEMBL17166663 0.93 L3MBTL1 (0.43) KDM4EATML3MBTL1ALDH1A1MAPT
SCHEMBL26952584 0.93 ATM (0.38) KDM4EATML3MBTL1ALDH1A1MAPT
SCHEMBL9890500 0.92 KDM4E (0.40) KDM4EATML3MBTL1LIMK1HDAC4
SCHEMBL26513478 0.92 L3MBTL1 (0.42) KDM4EATML3MBTL1ALDH1A1MAPT
SCHEMBL17248412 0.91 KDM4E (0.39) KDM4EATML3MBTL1ALDH1A1MAPT
SCHEMBL17166788 0.91 KDM4E (0.39) KDM4EATML3MBTL1ALDH1A1MAPT

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
EP-3835299-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME LG Chem, Ltd. (KR) 2021-06-16 EP disclosed