SCHEMBL24930818

SCHEMBL24930818

c1ccc(-c2nc(-c3cc(-c4cccc5oc6ccccc6c45)c4ccccc4c3)nc(-c3cc4ccccc4c4ccc5ccccc5c34)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
MAPT P10636 7/20 0.38
HPGD P15428 5/20 0.38
HSD17B10 Q99714 5/20 0.38
KDM4E B2RXH2 5/20 0.38
TSHR P16473 4/20 0.38
MAPK1 P28482 4/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
TP53 P04637 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
ATM Q13315 1/20 0.38
CASP1 P29466 2/20 0.38
HIF1A Q16665 1/20 0.38
ALOX15 P16050 2/20 0.35
CASP7 P55210 1/20 0.35
CYP1A2 P05177 2/20 0.34

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
SCHEMBL24931389 0.95 ALDH1A1 (0.38) ALDH1A1MAPTHPGDHSD17B10KDM4E
SCHEMBL24930460 0.95 ALDH1A1 (0.39) ALDH1A1MAPTHPGDHSD17B10KDM4E
SCHEMBL24930683 0.93 ALDH1A1 (0.39) ALDH1A1MAPTHPGDHSD17B10KDM4E
SCHEMBL24930694 0.93 L3MBTL1 (0.40) ALDH1A1MAPTHPGDHSD17B10KDM4E
SCHEMBL24930680 0.93 ALDH1A1 (0.39) ALDH1A1MAPTHPGDHSD17B10KDM4E
SCHEMBL24930708 0.92 TSHR (0.40) ALDH1A1MAPTHPGDHSD17B10KDM4E
SCHEMBL24930457 0.92 TSHR (0.40) ALDH1A1MAPTHPGDHSD17B10KDM4E
SCHEMBL24930624 0.92 TSHR (0.43) ALDH1A1MAPTHPGDHSD17B10KDM4E
SCHEMBL23822737 0.92 ALDH1A1 (0.42) ALDH1A1MAPTHPGDHSD17B10KDM4E
SCHEMBL23759528 0.92 L3MBTL1 (0.41) ALDH1A1MAPTHPGDHSD17B10KDM4E

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