SCHEMBL24277451

SCHEMBL24277451

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-c5cccc6c5Oc5cccc7cccc(c57)O6)cc4)cc3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.45
ATM Q13315 2/20 0.45
KDM4E B2RXH2 1/20 0.45
TYMS P04818 2/20 0.41
PDE6D O43924 1/20 0.33
AHR P35869 1/20 0.33
DRD2 P14416 1/20 0.32
HTR7 P34969 1/20 0.32
ADRA2A P08913 4/20 0.31
ADRA2B P18089 4/20 0.31
ADRA2C P18825 3/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GPR84 Q9NQS5 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
SCHEMBL24277446 1.00 MAPK1 (0.45) MAPK1ATMKDM4ETYMSPDE6D
SCHEMBL24277759 1.00 MAPK1 (0.45) MAPK1ATMKDM4ETYMSPDE6D
SCHEMBL24277758 1.00 MAPK1 (0.45) MAPK1ATMKDM4ETYMSPDE6D
SCHEMBL24277581 0.99 KDM4E (0.44) MAPK1ATMKDM4ETYMSPDE6D
SCHEMBL24277448 0.99 KDM4E (0.44) MAPK1ATMKDM4ETYMSPDE6D
SCHEMBL24277586 0.99 KDM4E (0.44) MAPK1ATMKDM4ETYMSPDE6D
SCHEMBL24277449 0.99 KDM4E (0.44) MAPK1ATMKDM4ETYMSPDE6D
SCHEMBL24277756 0.94 KDM4E (0.40) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL24277753 0.94 KDM4E (0.40) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL24277577 0.93 KDM4E (0.39) MAPK1ATMKDM4ETYMSALDH1A1

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-2022050533-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2022-03-10 WO disclosed