SCHEMBL24930830

SCHEMBL24930830

c1ccc(-c2nc(-c3ccc4c(-c5cccc6oc7ccccc7c56)cccc4c3)nc(-c3ccc4c(ccc5ccc6ccccc6c54)c3)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
KDM4E B2RXH2 6/20 0.42
HSD17B10 Q99714 6/20 0.42
MAPT P10636 5/20 0.42
HPGD P15428 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MAPK1 P28482 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TSHR P16473 2/20 0.42
ATM Q13315 2/20 0.42
TP53 P04637 2/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
CYP1A2 P05177 4/20 0.38
ABCG2 Q9UNQ0 3/20 0.38
FYN P06241 2/20 0.38
AHR P35869 2/20 0.38
CYP1A1 P04798 1/20 0.38

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
SCHEMBL24930774 0.98 ALDH1A1 (0.40) ALDH1A1KDM4EHSD17B10MAPTHPGD
SCHEMBL24930819 0.97 ALDH1A1 (0.40) ALDH1A1KDM4EHSD17B10MAPTHPGD
SCHEMBL24930832 0.96 L3MBTL1 (0.40) ALDH1A1KDM4EHSD17B10MAPTHPGD
SCHEMBL24930829 0.95 L3MBTL1 (0.39) ALDH1A1KDM4EHSD17B10MAPTHPGD
SCHEMBL24930693 0.95 ALDH1A1 (0.40) ALDH1A1KDM4EHSD17B10MAPTHPGD
SCHEMBL24930625 0.94 L3MBTL1 (0.40) ALDH1A1KDM4EHSD17B10MAPTHPGD
SCHEMBL25503558 0.94 ALDH1A1 (0.40) ALDH1A1KDM4EHSD17B10MAPTHPGD
SCHEMBL24930454 0.94 ALDH1A1 (0.43) ALDH1A1KDM4EHSD17B10MAPTHPGD
SCHEMBL24930684 0.94 TDP1 (0.42) ALDH1A1KDM4EHSD17B10MAPTHPGD
SCHEMBL23759437 0.94 TDP1 (0.42) ALDH1A1KDM4EHSD17B10MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed
WO-2023014190-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-02-09 WO disclosed
WO-2023003146-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-01-26 WO disclosed