SCHEMBL25854686

SCHEMBL25854686

c1ccc(C2(c3ccc(-c4cccc5c4-c4cccc6cccc(c46)O5)cc3)c3ccccc3-c3c2ccc2ccccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
MAPK1 P28482 1/20 0.39
ATM Q13315 1/20 0.39
TYMS P04818 2/20 0.33
DHFR P00374 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
OPRK1 P41145 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL25855298 0.92 KDM4E (0.37) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25859801 0.90 KDM4E (0.38) KDM4EMAPK1ATMTYMS
SCHEMBL25853822 0.90 KDM4E (0.41) KDM4EMAPK1ATMTYMSDHFR
SCHEMBL25855474 0.90 KDM4E (0.45) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25854695 0.88 KDM4E (0.38) KDM4EMAPK1ATMTYMSDHFR
SCHEMBL25859796 0.88 KDM4E (0.38) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25854690 0.86 KDM4E (0.42) KDM4EMAPK1ATM
SCHEMBL25854687 0.86 KDM4E (0.42) KDM4EMAPK1ATMTYMS
SCHEMBL25866895 0.86 DHFR (0.32) KDM4EMAPK1ATMTYMSDHFR
SCHEMBL25842062 0.86 KDM4E (0.40) KDM4EMAPK1ATMTYMS

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