SCHEMBL25859286

SCHEMBL25859286

CC1(C)c2cc(-c3cc4c5c(cccc5c3)-c3ccccc3O4)ccc2-c2cc3ccccc3cc21

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ATM Q13315 1/20 0.44
LPL P06858 1/20 0.33
LIPG Q9Y5X9 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
HIF1A Q16665 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PDK2 Q15119 9/20 0.32
TYMS P04818 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
SCHEMBL25843147 0.93 KDM4E (0.47) MAPK1KDM4EATMLPLLIPG
SCHEMBL25859290 0.89 MAPK1 (0.41) MAPK1KDM4EATMLPLLIPG
SCHEMBL25842354 0.88 MAPK1 (0.44) MAPK1KDM4EATMALDH1A1TP53
SCHEMBL25843224 0.88 KDM4E (0.47) MAPK1KDM4EATMLPLLIPG
SCHEMBL25860067 0.87 MAPK1 (0.49) MAPK1KDM4EATMALDH1A1TP53
SCHEMBL25859289 0.86 MAPK1 (0.43) MAPK1KDM4EATMALDH1A1TP53
SCHEMBL25843055 0.86 KDM4E (0.47) MAPK1KDM4EATMLPLLIPG
SCHEMBL25859285 0.85 KDM4E (0.42) MAPK1KDM4EATMLPLLIPG
SCHEMBL25842555 0.84 MAPK1 (0.44) MAPK1KDM4EATMALDH1A1TP53
SCHEMBL25841658 0.83 KDM4E (0.49) MAPK1KDM4EATMPDK2TYMS

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