SCHEMBL25008909

SCHEMBL25008909

c1ccc(-c2cccc3ccc(-c4nc(-c5cc6ccccc6c6ccccc56)nc(-c5cccc6oc7ccccc7c56)n4)cc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
KDM4E B2RXH2 5/20 0.37
HPGD P15428 4/20 0.37
TSHR P16473 4/20 0.37
HSD17B10 Q99714 4/20 0.37
MAPT P10636 4/20 0.37
CASP1 P29466 2/20 0.37
ALOX15 P16050 1/20 0.37
CASP7 P55210 1/20 0.37
L3MBTL1 Q9Y468 4/20 0.36
MAPK1 P28482 3/20 0.36
TDP1 Q9NUW8 3/20 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
KMT2A Q03164 3/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL25009012 0.94 MAPT (0.39) ALDH1A1KDM4EHPGDTSHRHSD17B10
SCHEMBL25008926 0.93 MAPT (0.39) ALDH1A1KDM4EHPGDTSHRHSD17B10
SCHEMBL25008349 0.93 MAPT (0.42) ALDH1A1KDM4EHPGDTSHRHSD17B10
SCHEMBL25008906 0.92 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDTSHRHSD17B10
SCHEMBL25008356 0.92 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDTSHRHSD17B10
SCHEMBL25008905 0.92 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDTSHRHSD17B10
SCHEMBL25008922 0.92 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDTSHRHSD17B10
SCHEMBL25009011 0.91 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDTSHRHSD17B10
SCHEMBL27368822 0.91 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDTSHRHSD17B10
SCHEMBL25008994 0.91 ALDH1A1 (0.40) ALDH1A1KDM4EHPGDTSHRHSD17B10

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-2023014004-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-02-09 WO disclosed