SCHEMBL7479629

SCHEMBL7479629

COc1cc(NC(=O)C(C)c2ccc(NC(=O)Nc3ccccc3[N+](=O)[O-])cc2)c(C(C)=O)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.59
PDGFRA P16234 1/20 0.54
KDR P35968 1/20 0.54
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 2/20 0.50
HPGD P15428 2/20 0.50
HSD17B10 Q99714 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
RCE1 Q9Y256 1/20 0.50
ABCG2 Q9UNQ0 2/20 0.49
ABCB1 P08183 1/20 0.49
THRB P10828 1/20 0.48
HTT P42858 1/20 0.48
GAA P10253 3/20 0.46
LMNA P02545 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL7484533 0.92 MAPT (0.58) MAPTPDGFRAKDRKMT2AMEN1
SCHEMBL7486681 0.89 MAPT (0.74) MAPTPDGFRAKDRKMT2AMEN1
SCHEMBL7478195 0.88 MAPT (0.59) MAPTPDGFRAKDRKMT2AMEN1
SCHEMBL7482289 0.88 KDM4E (0.65) MAPTKDRKMT2AMEN1KDM4E
SCHEMBL7476747 0.87 MAPT (0.62) MAPTPDGFRAKDRKMT2AMEN1
SCHEMBL7476977 0.85 KDM4E (0.53) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL7478548 0.84 MAPT (0.58) MAPTPDGFRAKDRKMT2AMEN1
SCHEMBL7477799 0.83 MAPT (0.53) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL7472611 0.83 MAPT (0.53) MAPTKDRKMT2AMEN1KDM4E
SCHEMBL1732403 0.83 ABCG2 (0.57) MAPTPDGFRAKDRKMT2AMEN1

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
EP-1229010-A1 NOVEL DIARYLAMIDE DERIVATIVES AND USE THEREOF AS MEDICINES Japan Energy Corporation (JP) 2002-08-07 EP disclosed