SCHEMBL24973151

SCHEMBL24973151

C1=CC(c2nc(-c3ccccc3)nc(-c3cccc4oc5cccc(-c6ccc7ccccc7c6)c5c34)n2)CC=C1c1cccc2ccccc12

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 2/20 0.33
TP53 P04637 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HSD17B10 Q99714 2/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
MAPK1 P28482 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 1/20 0.31
PIM1 P11309 1/20 0.30

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
SCHEMBL24314422 0.94 ALDH1A1 (0.33) ALDH1A1MAPTKDM4ETP53SMN1; SMN2
SCHEMBL24973499 0.91 KDM4E (0.31) ALDH1A1MAPTKDM4ETP53SMN1; SMN2
SCHEMBL24973163 0.90 MAPK1 (0.30) MAPK1KMT2A
SCHEMBL24972794 0.89 ALDH1A1 (0.32) ALDH1A1MAPTKDM4ETP53SMN1; SMN2
SCHEMBL26893675 0.88 ALDH1A1 (0.30) ALDH1A1MAPT
SCHEMBL24357034 0.88 PRKDC (0.31) ALDH1A1MAPTKDM4ETP53SMN1; SMN2
SCHEMBL24658032 0.87 ALDH1A1 (0.31) ALDH1A1MAPTKDM4ETP53SMN1; SMN2
SCHEMBL26373151 0.87 PRKDC (0.35) ALDH1A1KDM4ETP53SMN1; SMN2HSD17B10
SCHEMBL24907606 0.86 PLA2G2A (0.32)
SCHEMBL24971720 0.86 MAPK1 (0.31) ALDH1A1MAPTKDM4ETP53SMN1; SMN2

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-2023002447-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed