SCHEMBL25008906

SCHEMBL25008906

c1ccc(-c2cccc3cc(-c4nc(-c5cc6ccccc6c6ccccc56)nc(-c5cccc6oc7ccccc7c56)n4)ccc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
HPGD P15428 4/20 0.36
KDM4E B2RXH2 4/20 0.36
TSHR P16473 3/20 0.36
HSD17B10 Q99714 3/20 0.36
MAPT P10636 3/20 0.36
MAPK1 P28482 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TP53 P04637 1/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
ATM Q13315 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CASP1 P29466 2/20 0.36
HIF1A Q16665 1/20 0.36
RAB9A P51151 2/20 0.36
MAOB P27338 2/20 0.36
HSD17B1 P14061 1/20 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
SCHEMBL25008350 0.94 KDM4E (0.42) ALDH1A1HPGDKDM4ETSHRHSD17B10
SCHEMBL24657338 0.93 CYP11B1 (0.38) ALDH1A1HPGDKDM4ETSHRHSD17B10
SCHEMBL25008917 0.93 ALDH1A1 (0.39) ALDH1A1HPGDKDM4ETSHRHSD17B10
SCHEMBL25008927 0.93 KDM4E (0.41) ALDH1A1HPGDKDM4ETSHRHSD17B10
SCHEMBL25817880 0.93 HSD17B1 (0.40) ALDH1A1HPGDKDM4ETSHRHSD17B10
SCHEMBL25008997 0.93 ALDH1A1 (0.41) ALDH1A1HPGDKDM4ETSHRHSD17B10
SCHEMBL25008346 0.93 KDM4E (0.41) ALDH1A1HPGDKDM4ETSHRHSD17B10
SCHEMBL25008909 0.92 ALDH1A1 (0.37) ALDH1A1HPGDKDM4ETSHRHSD17B10
SCHEMBL25009011 0.92 ALDH1A1 (0.39) ALDH1A1HPGDKDM4ETSHRHSD17B10
SCHEMBL25009006 0.92 ALDH1A1 (0.40) ALDH1A1HPGDKDM4ETSHRHSD17B10

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