SCHEMBL366922

SCHEMBL366922

COc1ccc2c(C#N)c3ccccc3n2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 8/20 0.62
HTT P42858 6/20 0.62
MAPT P10636 6/20 0.62
KDM4E B2RXH2 6/20 0.62
MEN1 O00255 5/20 0.62
KMT2A Q03164 5/20 0.62
LMNA P02545 5/20 0.62
TDP1 Q9NUW8 5/20 0.62
MAPK1 P28482 4/20 0.62
NCOA3 Q9Y6Q9 2/20 0.62
PABPC1 P11940 1/20 0.62
CASP3 P42574 1/20 0.62
NCOA1 Q15788 1/20 0.62
SENP6 Q9GZR1 1/20 0.62
ALDH1A1 P00352 6/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
EGFR P00533 1/20 0.42
SRC P12931 1/20 0.42
GAA P10253 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
SCHEMBL367737 0.81 L3MBTL1 (0.45) L3MBTL1HTTMAPTKDM4EMEN1
SCHEMBL365640 0.79 KMT2A (0.43) L3MBTL1HTTMAPTKDM4EMEN1
SCHEMBL367731 0.77 L3MBTL1 (0.41) L3MBTL1HTTMAPTKDM4EMEN1
SCHEMBL366921 0.77 KDM4E (1.00) L3MBTL1HTTMAPTKDM4EMEN1
SCHEMBL364542 0.76 ALDH1A1 (0.59) L3MBTL1HTTMAPTKDM4EMEN1
SCHEMBL365547 0.74 ALDH1A1 (0.45) L3MBTL1HTTMAPTKDM4EMEN1
SCHEMBL365090 0.73 ALDH1A1 (0.68) L3MBTL1HTTMAPTKDM4EMEN1
SCHEMBL365134 0.72 KMT2A (0.50) MAPTKDM4EMEN1KMT2ACASP3
SCHEMBL365014 0.72 KDM4E (0.48) L3MBTL1HTTMAPTKDM4EMEN1
SCHEMBL364594 0.71 EGFR (0.44) L3MBTL1HTTMAPTKDM4EMEN1

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