SCHEMBL25855305

SCHEMBL25855305

c1ccc(C2(c3cccc(-c4cc5c6c(cccc6c4)Oc4ccccc4-5)c3)c3ccccc3-c3c2ccc2ccccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TYMS P04818 1/20 0.30
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
SCHEMBL25854693 0.93 KDM4E (0.41) KDM4EMAPK1ATMTYMS
SCHEMBL25855315 0.91 KDM4E (0.41) KDM4EMAPK1ATMTYMSCYP1A1
SCHEMBL25853825 0.91 KDM4E (0.43) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25854886 0.89 KDM4E (0.46) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25854700 0.87 KDM4E (0.41) KDM4EMAPK1ATM
SCHEMBL25856299 0.87 KDM4E (0.39) KDM4EMAPK1ATMCYP1A1CYP1A2
SCHEMBL25855298 0.87 KDM4E (0.37) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25855303 0.86 KDM4E (0.40) KDM4EMAPK1ATMCYP1A1CYP1A2
SCHEMBL25841812 0.86 KDM4E (0.42) KDM4EMAPK1ATMTYMS
SCHEMBL25841952 0.86 KDM4E (0.46) KDM4EMAPK1ATMTYMS

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