SCHEMBL5821140

SCHEMBL5821140

COc1ccc(Nc2cccc3c2C(=O)NC3=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.64
SRC P12931 1/20 0.64
STK10 O94804 4/20 0.56
SLK Q9H2G2 4/20 0.56
MAPT P10636 5/20 0.54
MAPK1 P28482 3/20 0.54
HSD17B10 Q99714 2/20 0.54
ALOX12 P18054 1/20 0.54
KDM4E B2RXH2 4/20 0.51
ALDH1A1 P00352 3/20 0.51
GAA P10253 3/20 0.51
HPGD P15428 2/20 0.51
GSK3B P49841 4/20 0.50
RAB9A P51151 4/20 0.49
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
TDP1 Q9NUW8 3/20 0.48
HTT P42858 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
NSD2 O96028 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
SCHEMBL7042345 0.82 MAPT (0.59) EGFRSRCSTK10SLKMAPT
SCHEMBL11878949 0.82 KDM4E (0.53) EGFRSRCSTK10SLKMAPT
SCHEMBL3259553 0.82 KDM4E (0.64) EGFRSRCSTK10SLKMAPT
SCHEMBL9566607 0.81 KDM4E (0.51) EGFRSRCMAPTMAPK1HSD17B10
SCHEMBL11596912 0.81 MAPT (0.58) EGFRSRCSTK10SLKMAPT
SCHEMBL9657357 0.81 EGFR (0.64) EGFRSRCSTK10SLKMAPT
SCHEMBL9566625 0.81 KDM4E (0.51) EGFRSRCSTK10SLKMAPT
SCHEMBL133403 0.81 EGFR (0.64) EGFRSRCSTK10SLKMAPT
SCHEMBL5814108 0.80 EGFR (0.88) EGFRSRCSTK10SLKMAPT
Hydrochloric Acid SCHEMBL5138495 0.80 KDM4E (0.62) EGFRSRCSTK10SLKMAPT

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-2006047514-A2 DAPH ANALOGS AND INHIBITION OF PROTEIN AGGREGATION WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2006-05-04 WO disclosed