SCHEMBL24930451

SCHEMBL24930451

c1ccc(-c2nc(-c3ccc4c(ccc5c6ccccc6ccc45)c3)nc(-c3ccc(-c4cccc5oc6ccccc6c45)c4ccccc34)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
HSD17B10 Q99714 5/20 0.39
MAPT P10636 5/20 0.39
HPGD P15428 4/20 0.39
TSHR P16473 4/20 0.39
L3MBTL1 Q9Y468 4/20 0.39
KDM4E B2RXH2 4/20 0.39
MAPK1 P28482 3/20 0.39
TDP1 Q9NUW8 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
TP53 P04637 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
ATM Q13315 1/20 0.39
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
SCHEMBL24930450 0.99 ALDH1A1 (0.39) ALDH1A1HSD17B10MAPTHPGDTSHR
SCHEMBL23822742 0.99 ALDH1A1 (0.39) ALDH1A1HSD17B10MAPTHPGDTSHR
SCHEMBL24357028 0.98 ALDH1A1 (0.40) ALDH1A1HSD17B10MAPTHPGDTSHR
SCHEMBL24315164 0.95 ALDH1A1 (0.37) ALDH1A1HSD17B10MAPTHPGDTSHR
SCHEMBL24930453 0.95 MAPT (0.39) ALDH1A1HSD17B10MAPTHPGDTSHR
SCHEMBL24930454 0.95 ALDH1A1 (0.43) ALDH1A1HSD17B10MAPTHPGDTSHR
SCHEMBL24930829 0.94 L3MBTL1 (0.39) ALDH1A1HSD17B10MAPTHPGDTSHR
SCHEMBL24930623 0.94 ALDH1A1 (0.39) ALDH1A1HSD17B10MAPTHPGDTSHR
SCHEMBL23820654 0.94 L3MBTL1 (0.40) ALDH1A1HSD17B10MAPTHPGDTSHR
SCHEMBL23759256 0.94 MAPT (0.41) ALDH1A1HSD17B10MAPTHPGDTSHR

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