SCHEMBL25859892

SCHEMBL25859892

c1ccc(C2(c3ccccc3-c3ccc4c(c3)-c3cccc5cccc(c35)O4)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.51
KDM4E B2RXH2 2/20 0.51
ATM Q13315 2/20 0.51
TYMS P04818 1/20 0.38
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
OPRK1 P41145 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
HIF1A Q16665 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL25855150 0.94 MAPK1 (0.46) MAPK1KDM4EATMTYMSMEN1
SCHEMBL25868271 0.92 KDM4E (0.48) MAPK1KDM4EATMTYMSMEN1
SCHEMBL25843526 0.91 MAPK1 (0.50) MAPK1KDM4EATMTYMSMEN1
SCHEMBL25855645 0.91 MAPK1 (0.50) MAPK1KDM4EATMTYMSMEN1
SCHEMBL25842884 0.90 KDM4E (0.49) MAPK1KDM4EATMTYMSMEN1
SCHEMBL25843357 0.90 KDM4E (0.49) MAPK1KDM4EATMTYMSMEN1
SCHEMBL25854890 0.90 KDM4E (0.49) MAPK1KDM4EATMTYMSMEN1
SCHEMBL25856140 0.90 KDM4E (0.44) MAPK1KDM4EATMTYMSMEN1
SCHEMBL25868724 0.89 KDM4E (0.48) MAPK1KDM4EATMTYMSMEN1
SCHEMBL25868137 0.88 MAPK1 (0.47) MAPK1KDM4EATMTYMSALDH1A1

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