SCHEMBL5200627

SCHEMBL5200627

CC(=O)NCCCCCCCCCCCCCCCCCC(N)=O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.73
MAPK1 P28482 1/20 0.73
HIF1A Q16665 1/20 0.73
ADRA1A P35348 1/20 0.69
PAOX Q6QHF9 4/20 0.65
PRMT1 Q99873 1/20 0.45
TSHR P16473 1/20 0.43
CASP2 P42575 1/20 0.42
EPHX1 P07099 4/20 0.41
ALDH1A1 P00352 1/20 0.41
NAMPT P43490 1/20 0.41
FOLH1 Q04609 1/20 0.41
MEN1 O00255 1/20 0.41
FAAH O00519 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
SOAT1 P35610 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL22984077 1.00 KDM4E (0.73) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL608623 1.00 KDM4E (0.73) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL25065006 0.98 KDM4E (0.68) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL1525045 0.91 KDM4E (0.64) KDM4EMAPK1HIF1AADRA1APAOX
Hexamethylenebisacetamide SCHEMBL9437043 0.88 KDM4E (0.84) KDM4EMAPK1HIF1AADRA1APAOX
Trifluoroacetic Acid SCHEMBL27664340 0.87 ADRA1A (0.59) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL14739904 0.85 KDM4E (1.00) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL6516953 0.85 KDM4E (1.00) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL14740196 0.85 KDM4E (1.00) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL1900654 0.85 KDM4E (1.00) KDM4EMAPK1HIF1AADRA1APAOX

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
EP-1350823-B1 Water based intercoat coating composition and multi-layer coating film-forming method by use of the same KANSAI PAINT CO LTD (JP) 2007-08-22 EP disclosed