SCHEMBL25860854

SCHEMBL25860854

CC1(C)c2cc(-c3ccc4c(c3)Oc3cccc5cccc-4c35)ccc2-c2ccc3ccccc3c21

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 1/20 0.47
ATM Q13315 1/20 0.47
TYMS P04818 1/20 0.35
ENPP3 O14638 1/20 0.31
ENPP1 P22413 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA9 Q16790 2/20 0.31
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
THRB P10828 1/20 0.30
APEX1 P27695 1/20 0.30
HTT P42858 1/20 0.30
RECQL P46063 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL25860066 0.92 KDM4E (0.46) KDM4EMAPK1ATMTYMSENPP3
SCHEMBL25859285 0.91 KDM4E (0.42) KDM4EMAPK1ATMENPP3ENPP1
SCHEMBL25859887 0.88 KDM4E (0.40) KDM4EMAPK1ATMTYMSENPP3
SCHEMBL25860983 0.88 KDM4E (0.46) KDM4EMAPK1ATMTYMSENPP3
SCHEMBL25860555 0.88 KDM4E (0.40) KDM4EMAPK1ATMTYMSENPP3
SCHEMBL25860852 0.87 KDM4E (0.43) KDM4EMAPK1ATMTYMSENPP3
SCHEMBL25843053 0.87 MAPK1 (0.53) KDM4EMAPK1ATMTYMS
SCHEMBL25843927 0.86 KDM4E (0.47) KDM4EMAPK1ATMTYMS
SCHEMBL19600433 0.85 KDM4E (0.46) KDM4EMAPK1ATMTYMSENPP3
SCHEMBL25859732 0.85 KDM4E (0.40) KDM4EMAPK1ATMENPP3ENPP1

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