SCHEMBL24930643

SCHEMBL24930643

C1=Cc2oc3cccc(-c4ccccc4-c4nc(-c5ccccc5)nc(-c5cc6ccccc6c6c5ccc5ccccc56)n4)c3c2CC1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
TSHR P16473 2/20 0.32
MAPK1 P28482 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
KDM4E B2RXH2 2/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CASP1 P29466 1/20 0.32
HIF1A Q16665 1/20 0.32
CYP1A1 P04798 1/20 0.31
CYP1A2 P05177 1/20 0.31
FYN P06241 1/20 0.31

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
SCHEMBL26326973 0.88 KDM4E (0.33) L3MBTL1ALDH1A1HPGDTSHRMAPK1
SCHEMBL24930630 0.86 ALDH1A1 (0.34) L3MBTL1ALDH1A1HPGDTSHRMAPK1
SCHEMBL21651627 0.85 TSHR (0.32) L3MBTL1ALDH1A1HPGDTSHRMAPK1
SCHEMBL25622508 0.85 MAPT (0.33) L3MBTL1ALDH1A1HPGDTSHRMAPK1
SCHEMBL26292531 0.85 MAPT (0.33) L3MBTL1ALDH1A1HPGDTSHRMAPK1
SCHEMBL26034903 0.83 MAPT (0.34) L3MBTL1ALDH1A1HPGDTSHRMAPK1
SCHEMBL24990914 0.82 L3MBTL1 (0.43) L3MBTL1ALDH1A1HPGDTSHRMAPK1
SCHEMBL24930860 0.81 TDP1 (0.32) L3MBTL1ALDH1A1HPGDTSHRMAPK1
SCHEMBL26080580 0.79 CHEK2 (0.32)
SCHEMBL27370006 0.79 BACE1 (0.32)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

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