SCHEMBL366758

SCHEMBL366758

N#Cc1c2ccccc2n2c[c]ccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.46
SRC P12931 1/20 0.46
ALDH1A1 P00352 9/20 0.45
KDM4E B2RXH2 6/20 0.45
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
L3MBTL1 Q9Y468 4/20 0.45
LMNA P02545 4/20 0.45
GAA P10253 4/20 0.45
MAPT P10636 3/20 0.45
HTT P42858 2/20 0.45
NCOA3 Q9Y6Q9 2/20 0.45
MAPK1 P28482 3/20 0.42
TDP1 Q9NUW8 3/20 0.42
PABPC1 P11940 1/20 0.42
CASP3 P42574 1/20 0.42
NCOA1 Q15788 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
STAT3 P40763 1/20 0.38
CACNA1B Q00975 1/20 0.37

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
SCHEMBL365090 0.78 ALDH1A1 (0.68) EGFRSRCALDH1A1KDM4EMEN1
SCHEMBL366757 0.75 ALDH1A1 (0.59) EGFRSRCALDH1A1KDM4EMEN1
SCHEMBL364542 0.71 ALDH1A1 (0.59) EGFRSRCALDH1A1KDM4EMEN1
SCHEMBL366922 0.68 L3MBTL1 (0.62) EGFRSRCALDH1A1KDM4EMEN1
SCHEMBL365547 0.66 ALDH1A1 (0.45) EGFRSRCALDH1A1KDM4EMEN1
SCHEMBL367737 0.65 L3MBTL1 (0.45) EGFRSRCALDH1A1KDM4EMEN1
SCHEMBL30319488 0.64 PARP1 (0.42) EGFRSRCALDH1A1KDM4EMEN1
SCHEMBL364541 0.62 KDM4E (1.00) EGFRSRCALDH1A1KDM4EMEN1
SCHEMBL150623 0.62 ALDH1A1 (0.64) EGFRSRCALDH1A1KDM4EMEN1
SCHEMBL29429129 0.62 ALDH1A1 (0.64) EGFRSRCALDH1A1KDM4EMEN1

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