SCHEMBL367329

SCHEMBL367329

CC(=O)c1ccc2c(C(N)=O)c3ccccn3c2c1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BAZ2B Q9UIF8 8/20 0.47
BAZ2A Q9UIF9 8/20 0.47
ALDH1A1 P00352 4/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
APAF1 O14727 1/20 0.42
G6PD P11413 1/20 0.42
PABPC1 P11940 1/20 0.42
CACNA1B Q00975 1/20 0.42
APBA1 Q02410 1/20 0.42
SAE1 Q9UBE0 1/20 0.42
UBA2 Q9UBT2 1/20 0.42
HPGD P15428 2/20 0.41
EGFR P00533 1/20 0.40
SRC P12931 1/20 0.40
BRD9 Q9H8M2 2/20 0.39
BRD4 O60885 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
SCHEMBL367763 0.91 BAZ2B (0.45) BAZ2BBAZ2AALDH1A1MAPTKDM4E
SCHEMBL367568 0.90 ALDH1A1 (0.44) BAZ2BBAZ2AALDH1A1MAPTKDM4E
SCHEMBL366875 0.87 EGFR (0.42) BAZ2BBAZ2AALDH1A1MAPTKDM4E
SCHEMBL365258 0.87 KDM4E (0.42) BAZ2BBAZ2AALDH1A1MAPTKDM4E
SCHEMBL365916 0.85 KDM4E (0.40) BAZ2BBAZ2AALDH1A1MAPTKDM4E
SCHEMBL365470 0.85 EGFR (0.45) BAZ2BBAZ2AALDH1A1MAPTKDM4E
Potassium Ion SCHEMBL364866 0.85 MAPT (0.40) BAZ2BBAZ2AALDH1A1MAPTKDM4E
SCHEMBL366441 0.84 ALDH1A1 (0.43) BAZ2BBAZ2AALDH1A1MAPTKDM4E
SCHEMBL364280 0.84 MAPT (0.47) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL366810 0.83 PTGS2 (0.45) BAZ2BBAZ2AALDH1A1MAPTKDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

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