SCHEMBL25879106

SCHEMBL25879106

c1ccc2c(c1)Oc1ccc(-c3cccc4c3-c3ccccc3C43c4c(ccc5ccccc45)-c4ccc5ccccc5c43)c3cccc-2c13

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
MAPK1 P28482 2/20 0.48
ATM Q13315 1/20 0.48
TYMS P04818 1/20 0.33
DNMT1 P26358 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
GLA P06280 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.30
CASP1 P29466 1/20 0.30
HIF1A Q16665 1/20 0.30
HSD17B10 Q99714 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL25843738 0.97 KDM4E (0.47) KDM4EMAPK1ATMTYMSDNMT1
SCHEMBL25868416 0.95 MAPK1 (0.46) KDM4EMAPK1ATMTYMSDNMT1
SCHEMBL25841950 0.91 KDM4E (0.48) KDM4EMAPK1ATMTYMSDNMT1
SCHEMBL25879105 0.91 KDM4E (0.48) KDM4EMAPK1ATMTYMSDNMT1
SCHEMBL25868551 0.90 MAPK1 (0.47) KDM4EMAPK1ATMTYMSDNMT1
SCHEMBL25868816 0.89 KDM4E (0.44) KDM4EMAPK1ATMTYMS
SCHEMBL25842977 0.88 MAPK1 (0.50) KDM4EMAPK1ATMTYMSALDH1A1
SCHEMBL25841666 0.88 KDM4E (0.47) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25868417 0.87 MAPK1 (0.49) KDM4EMAPK1ATMTYMSALDH1A1
SCHEMBL25868549 0.87 KDM4E (0.46) KDM4EMAPK1ATMTYMSMEN1

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