SCHEMBL367736

SCHEMBL367736

N#CCOc1ccc2c(C#N)c3ccccn3c2c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.70
KMT2A Q03164 7/20 0.70
MEN1 O00255 6/20 0.70
MAPT P10636 5/20 0.70
L3MBTL1 Q9Y468 4/20 0.70
LMNA P02545 3/20 0.70
MAPK1 P28482 2/20 0.70
HTT P42858 2/20 0.70
NCOA3 Q9Y6Q9 2/20 0.70
PABPC1 P11940 2/20 0.70
CASP3 P42574 1/20 0.70
NCOA1 Q15788 1/20 0.70
SENP6 Q9GZR1 1/20 0.70
TDP1 Q9NUW8 1/20 0.70
ALDH1A1 P00352 9/20 0.69
POLB P06746 1/20 0.64
GAA P10253 4/20 0.59
PSEN1 P49768 1/20 0.48
PSEN2 P49810 1/20 0.48
APH1B Q8WW43 1/20 0.48

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
SCHEMBL366921 0.82 KDM4E (1.00) KDM4EKMT2AMEN1MAPTL3MBTL1
SCHEMBL364899 0.80 ALDH1A1 (0.55) KDM4EKMT2AMEN1MAPTL3MBTL1
SCHEMBL365539 0.79 ALDH1A1 (0.54) KDM4EKMT2AMEN1MAPTL3MBTL1
SCHEMBL366632 0.79 ALDH1A1 (0.54) KDM4EKMT2AMEN1MAPTL3MBTL1
SCHEMBL366031 0.79 ALDH1A1 (0.59) KDM4EKMT2AMEN1MAPTL3MBTL1
SCHEMBL367737 0.78 L3MBTL1 (0.45) KDM4EKMT2AMEN1MAPTL3MBTL1
SCHEMBL364901 0.78 ALDH1A1 (0.58) KDM4EKMT2AMEN1MAPTL3MBTL1
SCHEMBL364972 0.77 KMT2A (0.57) KDM4EKMT2AMEN1MAPTL3MBTL1
SCHEMBL365358 0.76 ALDH1A1 (0.68) KDM4EKMT2AMEN1MAPTL3MBTL1
SCHEMBL367730 0.75 KDM4E (0.64) KDM4EKMT2AMEN1MAPTL3MBTL1

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-2012007008-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed