SCHEMBL25848422

SCHEMBL25848422

c1ccc2c(c1)Oc1cc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4cc5ccccc5cc43)ccc1C21c2ccccc2-c2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ATM Q13315 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
PDK2 Q15119 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
SCHEMBL25848416 0.94 KDM4E (0.33) MAPK1KDM4EATM
SCHEMBL25848317 0.93 KDM4E (0.31) MAPK1KDM4EATMPDK2
SCHEMBL25847506 0.91 FTO (0.34) MAPK1KDM4EATMALDH1A1HPGD
SCHEMBL25851476 0.90 PDK2 (0.32) MAPK1KDM4EATMALDH1A1TP53
SCHEMBL25873349 0.90 PDK2 (0.32) MAPK1KDM4EATMPDK2
SCHEMBL25849370 0.89 MAPK1 (0.41) MAPK1KDM4EATMALDH1A1TP53
SCHEMBL25848524 0.89 PDK2 (0.33) MAPK1KDM4EATMALDH1A1HPGD
SCHEMBL25871887 0.88 KDM4E (0.33) MAPK1KDM4EATM
SCHEMBL25848170 0.87 PDK2 (0.37) PDK2
SCHEMBL25864079 0.87 PDK2 (0.37) PDK2

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