SCHEMBL25859647

SCHEMBL25859647

c1ccc(C2(c3ccccc3)c3cc(-c4ccc5cccc6c5c4Oc4ccccc4-6)ccc3-c3ccc4ccccc4c32)cc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.38
ATM Q13315 1/20 0.38
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
SCHEMBL25856303 0.92 KDM4E (0.36) KDM4EMAPK1ATMCYP1A1CYP1A2
SCHEMBL25855934 0.92 KDM4E (0.38) KDM4EMAPK1ATM
SCHEMBL25860398 0.92 KDM4E (0.38) KDM4EMAPK1ATMCYP1A1CYP1A2
SCHEMBL25844068 0.91 KDM4E (0.40) KDM4EMAPK1ATM
SCHEMBL25859643 0.91 KDM4E (0.40) KDM4EMAPK1ATM
SCHEMBL25842882 0.89 KDM4E (0.41) KDM4EMAPK1ATM
SCHEMBL25859645 0.88 KDM4E (0.37) KDM4EMAPK1ATM
SCHEMBL25859575 0.88 KDM4E (0.42) KDM4EMAPK1ATM
SCHEMBL25859735 0.87 MAPK1 (0.40) KDM4EMAPK1ATM
SCHEMBL25843822 0.86 KDM4E (0.39) KDM4EMAPK1ATM

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