SCHEMBL27368650

SCHEMBL27368650

c1ccc(-c2cc3ccccc3c3cc(-c4nc(-c5cccc6ccccc56)nc(-c5cccc6oc7ccccc7c56)n4)ccc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.39
KDM4E B2RXH2 6/20 0.39
HPGD P15428 5/20 0.39
MAPT P10636 5/20 0.39
HSD17B10 Q99714 5/20 0.39
TSHR P16473 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
MAPK1 P28482 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
ATM Q13315 2/20 0.39
TP53 P04637 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MPI P34949 1/20 0.37
CASP1 P29466 2/20 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
SCHEMBL27368931 0.96 ALDH1A1 (0.38) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL27368333 0.95 KDM4E (0.37) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL27368663 0.94 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL27368460 0.94 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL27369021 0.94 PLA2G2A (0.38) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL27368822 0.93 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL27368343 0.93 PLA2G2A (0.36) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL27368833 0.93 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL27369016 0.93 PLA2G2A (0.36) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL27369035 0.93 PLA2G2A (0.38) ALDH1A1KDM4EHPGDMAPTHSD17B10

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-2024049159-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2024-03-07 WO disclosed