SCHEMBL24930705

SCHEMBL24930705

c1ccc(-c2cccc3oc4ccccc4c23)c(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc4c(ccc5ccc6ccccc6c54)c3)n2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
CYP1A1 P04798 1/20 0.36
CYP1B1 Q16678 1/20 0.36
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 3/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
MAPK1 P28482 2/20 0.36
CASP1 P29466 2/20 0.36
HIF1A Q16665 2/20 0.36
PIM1 P11309 1/20 0.35
MAPT P10636 2/20 0.34
ANPEP P15144 1/20 0.34
ABCG2 Q9UNQ0 3/20 0.33
TP53 P04637 2/20 0.33
CYP1A2 P05177 2/20 0.33
AHR P35869 2/20 0.33
CASP7 P55210 1/20 0.33
ERBB2 P04626 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
SCHEMBL24930707 0.96 L3MBTL1 (0.40) L3MBTL1TDP1CYP1A1CYP1B1ALDH1A1
SCHEMBL24930285 0.95 L3MBTL1 (0.38) L3MBTL1TDP1CYP1A1CYP1B1ALDH1A1
SCHEMBL24930691 0.95 TDP1 (0.43) L3MBTL1TDP1CYP1A1CYP1B1ALDH1A1
SCHEMBL24990497 0.94 L3MBTL1 (0.40) L3MBTL1TDP1CYP1A1CYP1B1ALDH1A1
SCHEMBL24930625 0.94 L3MBTL1 (0.40) L3MBTL1TDP1CYP1A1CYP1B1ALDH1A1
SCHEMBL24990496 0.94 TDP1 (0.40) L3MBTL1TDP1CYP1A1CYP1B1ALDH1A1
SCHEMBL24930620 0.94 ALDH1A1 (0.40) L3MBTL1TDP1CYP1A1CYP1B1ALDH1A1
SCHEMBL24930642 0.93 L3MBTL1 (0.42) L3MBTL1TDP1CYP1A1CYP1B1ALDH1A1
SCHEMBL24930232 0.93 TDP1 (0.44) L3MBTL1TDP1CYP1A1ALDH1A1HSD17B10
SCHEMBL23820339 0.93 ALDH1A1 (0.38) L3MBTL1TDP1CYP1A1CYP1B1ALDH1A1

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