SCHEMBL14601546

SCHEMBL14601546

CNC(=O)CC(=O)NCNC(=O)CC(=O)NCNC(C)=O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
MAPK1 P28482 1/20 0.37
HIF1A Q16665 1/20 0.37
MCL1 Q07820 1/20 0.34
TSHR P16473 1/20 0.34
LMNA P02545 1/20 0.34
ALDH1A1 P00352 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KMT2A Q03164 1/20 0.32
PAOX Q6QHF9 3/20 0.31
ADRA1A P35348 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
SCHEMBL13219609 0.80 KDM4E (0.40) KDM4EMAPK1HIF1ATSHRLMNA
SCHEMBL170514 0.79
SCHEMBL26202990 0.78 ADRA1A (0.40) KDM4EMAPK1HIF1ATSHRLMNA
SCHEMBL14258484 0.78 KDM4E (0.39) KDM4EMAPK1HIF1ATSHRALDH1A1
SCHEMBL2106440 0.76
SCHEMBL260170 0.75 KDM4E (0.40) KDM4EMAPK1HIF1ATSHRALDH1A1
SCHEMBL11887087 0.75 MEN1 (0.50) KDM4EMAPK1HIF1ATSHRALDH1A1
SCHEMBL6754730 0.73
SCHEMBL17403434 0.73 KDM4E (0.39) KDM4EMAPK1HIF1ATSHRALDH1A1
SCHEMBL13392107 0.73 MGAM (0.35) KDM4ELMNAALDH1A1

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
US-7160949-B2 Olefin block copolymers, processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2007-01-09 US disclosed