SCHEMBL25908152

SCHEMBL25908152

CC1(C)OB(c2ccc3c(c2)-c2cccc4cccc(c24)O3)OC1(C)C

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.51
MAPK1 P28482 1/20 0.51
ATM Q13315 1/20 0.51
LIPG Q9Y5X9 13/20 0.43
LPL P06858 12/20 0.43
TYMS P04818 1/20 0.41
IRAK4 Q9NWZ3 1/20 0.36
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
EGFR P00533 1/20 0.34
F11 P03951 1/20 0.33
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33

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
SCHEMBL31062339 1.00 KDM4E (0.51) KDM4EMAPK1ATMLIPGLPL
SCHEMBL17776257 0.89 KDM4E (0.51) KDM4EMAPK1ATMLIPGLPL
SCHEMBL25908302 0.85 KDM4E (0.53) KDM4EMAPK1ATMLIPGLPL
SCHEMBL21764405 0.84 LPL (0.47) KDM4EMAPK1ATMLIPGLPL
SCHEMBL2229145 0.81 LIPG (0.48) MAPK1ATMLIPGLPLTYMS
SCHEMBL23504623 0.79 LPL (0.47) KDM4EMAPK1ATMLIPGLPL
SCHEMBL26447360 0.76 LIPG (0.46) KDM4EMAPK1ATMLIPGLPL
SCHEMBL16558521 0.75 LIPG (0.39) KDM4EMAPK1ATMLIPGLPL
SCHEMBL21385123 0.75 LPL (0.38) KDM4EMAPK1ATMLIPGLPL
SCHEMBL21382836 0.75 LIPG (0.42) LIPGLPLTYMSIRAK4CA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023223855-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-11-23 WO disclosed
EP-4238953-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE Idemitsu Kosan Co., Ltd (JP) 2023-09-06 EP disclosed
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