SCHEMBL25849424

SCHEMBL25849424

c1ccc2c(c1)Oc1cccc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4cccc5cccc3c45)c1C21c2ccccc2-c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.44
ATM Q13315 2/20 0.44
KDM4E B2RXH2 1/20 0.44
TYMS P04818 2/20 0.34
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
HIF1A Q16665 1/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 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
SCHEMBL25849369 0.92 KDM4E (0.40) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25850539 0.92 MAPK1 (0.49) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25847571 0.92 KDM4E (0.36) MAPK1ATMKDM4E
SCHEMBL25849361 0.88 MAPK1 (0.41) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25848424 0.87 MAPK1 (0.36) MAPK1ATMKDM4EALDH1A1TSHR
SCHEMBL25842974 0.85 MAPK1 (0.53) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25852348 0.84 KDM4E (0.38) MAPK1ATMKDM4E
SCHEMBL25850388 0.84 KDM4E (0.36) MAPK1ATMKDM4EALDH1A1HPGD
SCHEMBL25871683 0.84 MAPK1 (0.39) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25842979 0.83 MAPK1 (0.50) 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