SCHEMBL25860840

SCHEMBL25860840

c1ccc(C2(c3ccccc3)c3cc(-c4ccc5c(c4)Oc4cccc6cccc-5c46)ccc3-c3c2ccc2ccccc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
MAPK1 P28482 1/20 0.44
ATM Q13315 1/20 0.44
TYMS P04818 1/20 0.33
ANPEP P15144 1/20 0.31
CYP1A1 P04798 1/20 0.30
CYP1A2 P05177 1/20 0.30
FYN P06241 1/20 0.30
MAPK3 P27361 1/20 0.30
AHR P35869 1/20 0.30
PAX8 Q06710 1/20 0.30
ABCG2 Q9UNQ0 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
SCHEMBL25854687 0.94 KDM4E (0.42) KDM4EMAPK1ATMTYMSANPEP
SCHEMBL25859179 0.93 KDM4E (0.41) KDM4EMAPK1ATMANPEP
SCHEMBL25860059 0.93 KDM4E (0.43) KDM4EMAPK1ATMTYMSANPEP
SCHEMBL25853823 0.91 KDM4E (0.43) KDM4EMAPK1ATMTYMSANPEP
SCHEMBL25860845 0.90 KDM4E (0.45) KDM4EMAPK1ATMTYMSANPEP
SCHEMBL25841808 0.90 KDM4E (0.45) KDM4EMAPK1ATMTYMSANPEP
SCHEMBL25859434 0.90 KDM4E (0.42) KDM4EMAPK1ATMANPEP
SCHEMBL25859801 0.89 KDM4E (0.38) KDM4EMAPK1ATMTYMSCYP1A1
SCHEMBL25860396 0.88 KDM4E (0.37) KDM4EMAPK1ATMTYMSANPEP
SCHEMBL25860841 0.88 KDM4E (0.45) KDM4EMAPK1ATMTYMSCYP1A1

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-2023120714-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-06-29 WO disclosed