SCHEMBL24949595

SCHEMBL24949595

Clc1cccc(-c2ccccc2)c1-c1ccc(-n2c3ccccc3c3ccc4ccccc4c32)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.43
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KMT2A Q03164 1/20 0.34
RORC P51449 2/20 0.34
CYP2A6 P11509 2/20 0.33
CYP1A2 P05177 1/20 0.33
PDE10A Q9Y233 1/20 0.32
ENPP1 P22413 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
CNR2 P34972 1/20 0.32
PDE6D O43924 1/20 0.32
DUSP3 P51452 1/20 0.32
RARG P13631 1/20 0.31
HPGD P15428 1/20 0.30
TP53 P04637 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
SCHEMBL24948358 0.86 L3MBTL1 (0.49) MAPK14KDM4EATML3MBTL1KMT2A
SCHEMBL19271550 0.84 KDM4E (0.41) MAPK14KDM4EATML3MBTL1CYP1A2
SCHEMBL23702385 0.84 L3MBTL1 (0.44) KDM4EATML3MBTL1KMT2ACYP2A6
SCHEMBL24973447 0.83 MCL1 (0.36) MAPK14KDM4EATML3MBTL1KMT2A
SCHEMBL24947205 0.82 MAPK14 (0.38) MAPK14CYP1A2ENPP1ESR1ESR2
SCHEMBL24374431 0.82 L3MBTL1 (0.37) MAPK14KDM4EATML3MBTL1RORC
SCHEMBL27451924 0.82 KDM4E (0.44) MAPK14KDM4EATML3MBTL1CYP1A2
SCHEMBL15073677 0.81 KDM4E (0.49) MAPK14KDM4EATML3MBTL1CYP1A2
SCHEMBL17014594 0.81 PDE6D (0.34) MAPK14KDM4EATML3MBTL1KMT2A
SCHEMBL24949586 0.81 MAPK14 (0.38) MAPK14KDM4EATML3MBTL1KMT2A

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