SCHEMBL25008916

SCHEMBL25008916

c1ccc(-c2nc(-c3cc(-c4cc5ccccc5c5ccccc45)c4ccccc4c3)nc(-c3cccc4oc5ccccc5c34)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.40
MAPT P10636 8/20 0.40
KDM4E B2RXH2 6/20 0.40
TSHR P16473 5/20 0.40
HPGD P15428 5/20 0.40
HSD17B10 Q99714 5/20 0.40
MAPK1 P28482 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
TP53 P04637 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
ATM Q13315 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CASP1 P29466 2/20 0.37
HIF1A Q16665 1/20 0.37
CYP11B1 P15538 1/20 0.36
RAB9A P51151 4/20 0.36
NPC1 O15118 2/20 0.36

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
SCHEMBL23820378 0.96 ALDH1A1 (0.39) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL23821736 0.95 MAPT (0.42) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL24657338 0.94 CYP11B1 (0.38) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL25008917 0.94 ALDH1A1 (0.39) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL25008331 0.94 ALDH1A1 (0.44) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL24314573 0.93 ALDH1A1 (0.40) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL24307022 0.93 MAPT (0.40) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL25008347 0.93 MAPT (0.42) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL25668673 0.93 ALDH1A1 (0.39) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL21707171 0.92 MAPT (0.43) ALDH1A1MAPTKDM4ETSHRHPGD

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
EP-4289836-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME Lg Chem, Ltd. (KR) 2023-12-13 EP disclosed
WO-2023014004-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-02-09 WO disclosed