SCHEMBL25843147

SCHEMBL25843147

CC1(C)c2ccccc2-c2ccc(-c3cc4c5c(cccc5c3)-c3ccccc3O4)cc21

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
MAPK1 P28482 1/20 0.47
ATM Q13315 1/20 0.47
PDK2 Q15119 11/20 0.33
LPL P06858 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
TYMS P04818 1/20 0.31

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
SCHEMBL25859286 0.93 MAPK1 (0.44) KDM4EMAPK1ATMPDK2LPL
SCHEMBL25843055 0.93 KDM4E (0.47) KDM4EMAPK1ATMPDK2LPL
SCHEMBL25843224 0.93 KDM4E (0.47) KDM4EMAPK1ATMLPLLIPG
SCHEMBL25843053 0.90 MAPK1 (0.53) KDM4EMAPK1ATMPDK2TYMS
SCHEMBL25841658 0.88 KDM4E (0.49) KDM4EMAPK1ATMPDK2TYMS
SCHEMBL25859285 0.88 KDM4E (0.42) KDM4EMAPK1ATMLPLLIPG
SCHEMBL25843167 0.86 KDM4E (0.48) KDM4EMAPK1ATMLPLLIPG
SCHEMBL25843148 0.86 MAPK1 (0.51) KDM4EMAPK1ATMPDK2TYMS
SCHEMBL25842971 0.86 KDM4E (0.43) KDM4EMAPK1ATMPDK2
SCHEMBL25868726 0.85 MAPK1 (0.50) KDM4EMAPK1ATMPDK2TYMS

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