SCHEMBL24930822

SCHEMBL24930822

c1ccc(-c2nc(-c3cc(-c4cccc5oc6ccccc6c45)c4ccccc4c3)nc(-c3ccc4c(ccc5c6ccccc6ccc45)c3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.41
HSD17B10 Q99714 8/20 0.41
MAPT P10636 7/20 0.41
KDM4E B2RXH2 7/20 0.41
HPGD P15428 6/20 0.41
TSHR P16473 4/20 0.41
L3MBTL1 Q9Y468 4/20 0.41
MAPK1 P28482 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
ATM Q13315 2/20 0.41
TP53 P04637 2/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
CASP1 P29466 2/20 0.37
ALOX15 P16050 1/20 0.37
CASP7 P55210 1/20 0.37
KMT2A Q03164 2/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL23822737 0.99 ALDH1A1 (0.42) ALDH1A1HSD17B10MAPTKDM4EHPGD
SCHEMBL24930805 0.98 ALDH1A1 (0.40) ALDH1A1HSD17B10MAPTKDM4EHPGD
SCHEMBL23821747 0.98 ALDH1A1 (0.41) ALDH1A1HSD17B10MAPTKDM4EHPGD
SCHEMBL23820435 0.95 ALDH1A1 (0.41) ALDH1A1HSD17B10MAPTKDM4EHPGD
SCHEMBL24930454 0.95 ALDH1A1 (0.43) ALDH1A1HSD17B10MAPTKDM4EHPGD
SCHEMBL25843092 0.94 ALDH1A1 (0.39) ALDH1A1HSD17B10MAPTKDM4EHPGD
SCHEMBL24930693 0.94 ALDH1A1 (0.40) ALDH1A1HSD17B10MAPTKDM4EHPGD
SCHEMBL25503651 0.93 ALDH1A1 (0.39) ALDH1A1HSD17B10MAPTKDM4EHPGD
SCHEMBL23821779 0.93 ALDH1A1 (0.43) ALDH1A1HSD17B10MAPTKDM4EHPGD
SCHEMBL23384886 0.93 ALDH1A1 (0.42) ALDH1A1HSD17B10MAPTKDM4EHPGD

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