SCHEMBL25854121

SCHEMBL25854121

c1ccc(C2(c3ccc(-c4cccc5c4-c4cccc6cccc(c46)O5)cc3)c3ccccc3-c3cc4ccccc4cc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
MAPK1 P28482 2/20 0.40
ATM Q13315 1/20 0.40
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
OPRK1 P41145 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TYMS P04818 1/20 0.34
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
HIF1A Q16665 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL25855474 0.93 KDM4E (0.45) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25854392 0.92 KDM4E (0.39) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25859890 0.92 MAPK1 (0.40) KDM4EMAPK1ATMTYMSALDH1A1
SCHEMBL25855007 0.91 MAPK1 (0.43) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25842877 0.90 KDM4E (0.42) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25843377 0.90 KDM4E (0.42) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25854232 0.89 KDM4E (0.38) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25842480 0.87 MAPK1 (0.42) KDM4EMAPK1ATMTYMSALDH1A1
SCHEMBL25854234 0.87 KDM4E (0.40) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25854812 0.86 KDM4E (0.43) 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