SCHEMBL25842609

SCHEMBL25842609

c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2cc(-c3ccc4c(c3)Oc3cccc5cccc-4c35)ccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.54
ATM Q13315 2/20 0.54
KDM4E B2RXH2 2/20 0.54
TYMS P04818 1/20 0.40
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
HIF1A Q16665 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PDK2 Q15119 5/20 0.32
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
OPRK1 P41145 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL25843640 0.97 MAPK1 (0.51) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25842483 0.95 MAPK1 (0.49) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25841649 0.93 MAPK1 (0.55) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25843515 0.93 KDM4E (0.49) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25842237 0.91 MAPK1 (0.50) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25860837 0.91 MAPK1 (0.50) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25843360 0.91 MAPK1 (0.53) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25842123 0.91 KDM4E (0.45) MAPK1ATMKDM4ETYMS
SCHEMBL25842617 0.91 MAPK1 (0.55) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25843165 0.90 MAPK1 (0.51) MAPK1ATMKDM4ETYMSALDH1A1

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