SCHEMBL25875723

SCHEMBL25875723

CC1(C)c2ccccc2-c2ccc(-c3ccc4c5c(cccc35)-c3ccc(-c5ccccc5)cc3O4)cc21

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 13/20 0.37
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.32
BACE1 P56817 1/20 0.31
PGR P06401 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
SCHEMBL19600422 0.94 KDM4E (0.37) PDK2KDM4EMAPK1ATM
SCHEMBL25875589 0.93 PDK2 (0.37) PDK2KDM4EMAPK1ATMBACE1
SCHEMBL25868886 0.91 KDM4E (0.39) PDK2KDM4EMAPK1ATM
SCHEMBL25843054 0.91 KDM4E (0.41) PDK2KDM4EMAPK1ATM
SCHEMBL19600433 0.90 KDM4E (0.46) PDK2KDM4EMAPK1ATM
SCHEMBL25875483 0.90 PDK2 (0.35) PDK2KDM4EMAPK1ATMPGR
SCHEMBL19600400 0.89 KDM4E (0.40) PDK2KDM4EMAPK1ATM
SCHEMBL25874826 0.88 PDK2 (0.39) PDK2KDM4EMAPK1ATM
SCHEMBL25876737 0.88 KDM4E (0.34) PDK2KDM4EMAPK1ATMPGR
SCHEMBL13507652 0.87 PDK2 (0.36) PDK2KDM4EMAPK1ATM

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