SCHEMBL25854122

SCHEMBL25854122

c1ccc(C2(c3ccc(-c4ccc5c(c4)Oc4cccc6cccc-5c46)cc3)c3ccccc3-c3cc4ccccc4cc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
MAPK1 P28482 2/20 0.45
ATM Q13315 1/20 0.45
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
OPRK1 P41145 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PDK2 Q15119 6/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
HIF1A Q16665 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TYMS P04818 1/20 0.33

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
SCHEMBL25854394 0.95 KDM4E (0.44) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25855637 0.94 MAPK1 (0.50) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25855009 0.92 MAPK1 (0.46) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25842878 0.92 MAPK1 (0.50) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25859968 0.91 KDM4E (0.45) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25843515 0.91 KDM4E (0.49) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25860837 0.90 MAPK1 (0.50) KDM4EMAPK1ATMPDK2ALDH1A1
SCHEMBL25842237 0.90 MAPK1 (0.50) KDM4EMAPK1ATMPDK2ALDH1A1
SCHEMBL25854236 0.89 KDM4E (0.42) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25854813 0.89 KDM4E (0.49) KDM4EMAPK1ATMMEN1LMNA

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