SCHEMBL22340557

SCHEMBL22340557

CC(=O)NCCCCCOCCOCCNC(C)=O

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.64
MAPK1 P28482 1/20 0.64
HIF1A Q16665 1/20 0.64
PAOX Q6QHF9 3/20 0.53
ADRA1A P35348 1/20 0.52
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
EPHX2 P34913 9/20 0.42
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
ACHE P22303 1/20 0.40

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
SCHEMBL22525950 0.89 KDM4E (0.59) KDM4EMAPK1HIF1APAOXMEN1
SCHEMBL12123508 0.89 CES2 (0.53) KDM4EMAPK1HIF1APAOXMEN1
SCHEMBL23560302 0.89 KDM4E (0.59) KDM4EMAPK1HIF1APAOXMEN1
SCHEMBL24340726 0.89 CES2 (0.53) KDM4EMAPK1HIF1APAOXMEN1
SCHEMBL8545916 0.89 CES2 (0.53) KDM4EMAPK1HIF1APAOXMEN1
SCHEMBL5693542 0.87 KDM4E (0.61) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL5155263 0.87 MEN1 (0.56) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL19309079 0.87 MEN1 (0.56) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL22340561 0.87 KDM4E (0.48) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL22340558 0.87 KDM4E (0.48) KDM4EMAPK1HIF1APAOXADRA1A

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-2020162725-A1 TARGET PROTEIN EED DEGRADATION-INDUCING DEGRADUCER, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING DISEASES RELATED TO EED, EZH2, OR PRC2, COMPRISING SAME AS ACTIVE INGREDIENT 한국화학연구원 2020-08-13 WO disclosed