SCHEMBL24930645

SCHEMBL24930645

c1ccc(-c2ccc3c(c2)oc2cccc(-c4ccccc4-c4nc(-c5ccccc5)nc(-c5ccc6ccc7c8ccccc8ccc7c6c5)n4)c23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
MAPT P10636 4/20 0.37
HPGD P15428 3/20 0.37
TSHR P16473 3/20 0.37
HSD17B10 Q99714 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
MAPK1 P28482 3/20 0.37
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
TP53 P04637 1/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
ATM Q13315 1/20 0.37
CASP1 P29466 2/20 0.34
HIF1A Q16665 1/20 0.34
ALOX15 P16050 1/20 0.34
CASP7 P55210 1/20 0.34
NPC1 O15118 1/20 0.33

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
SCHEMBL24930761 0.95 MAPT (0.39) ALDH1A1MAPTHPGDTSHRHSD17B10
SCHEMBL24990338 0.94 MAPT (0.36) ALDH1A1MAPTHPGDTSHRHSD17B10
SCHEMBL24930581 0.94 MAPT (0.38) ALDH1A1MAPTHPGDTSHRHSD17B10
SCHEMBL24930627 0.94 MAPT (0.39) ALDH1A1MAPTHPGDTSHRHSD17B10
SCHEMBL23821369 0.94 MAPT (0.39) ALDH1A1MAPTHPGDTSHRHSD17B10
SCHEMBL23820158 0.94 MAPT (0.39) ALDH1A1MAPTHPGDTSHRHSD17B10
SCHEMBL23821005 0.94 MAPT (0.39) ALDH1A1MAPTHPGDTSHRHSD17B10
SCHEMBL24887950 0.94 MAPT (0.39) ALDH1A1MAPTHPGDTSHRHSD17B10
SCHEMBL24990901 0.94 MAPT (0.39) ALDH1A1MAPTHPGDTSHRHSD17B10
SCHEMBL23822635 0.93 MAPT (0.40) ALDH1A1MAPTHPGDTSHRHSD17B10

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