SCHEMBL364542

SCHEMBL364542

N#Cc1c2ccccc2n2cc(O)ccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.59
MEN1 O00255 6/20 0.59
KMT2A Q03164 6/20 0.59
KDM4E B2RXH2 5/20 0.59
L3MBTL1 Q9Y468 5/20 0.59
MAPT P10636 4/20 0.59
GAA P10253 4/20 0.59
LMNA P02545 3/20 0.59
HTT P42858 2/20 0.59
NCOA3 Q9Y6Q9 2/20 0.59
CACNA1B Q00975 1/20 0.44
APBA1 Q02410 1/20 0.44
EGFR P00533 1/20 0.41
SRC P12931 1/20 0.41
MAPK1 P28482 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
PABPC1 P11940 1/20 0.41
CASP3 P42574 1/20 0.41
NCOA1 Q15788 1/20 0.41
SENP6 Q9GZR1 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
SCHEMBL365547 0.77 ALDH1A1 (0.45) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL365090 0.77 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL366922 0.76 L3MBTL1 (0.62) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL364541 0.74 KDM4E (1.00) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL365000 0.74 HTT (0.42) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL367737 0.73 L3MBTL1 (0.45) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL365640 0.71 KMT2A (0.43) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL366758 0.71 EGFR (0.46) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL366926 0.70 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL366888 0.70 EGFR (0.44) ALDH1A1MEN1KMT2AKDM4EGAA

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