SCHEMBL366738

SCHEMBL366738

CNS(=O)(=O)c1ccc2c(C(=O)OC)c3ccccc3n2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
NR4A2 P43354 4/20 0.44
IDO1 P14902 1/20 0.40
RORC P51449 1/20 0.40
ALDH1A1 P00352 3/20 0.40
GAA P10253 2/20 0.40
KDM4E B2RXH2 2/20 0.40
F2 P00734 1/20 0.40
PLAU P00749 1/20 0.40
ELANE P08246 1/20 0.40
THRB P10828 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
EGFR P00533 1/20 0.38
SRC P12931 1/20 0.38

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
SCHEMBL365826 0.87 KMT2A (0.48) KMT2AMEN1NR4A2IDO1ALDH1A1
SCHEMBL365427 0.86 ALDH1A1 (0.48) KMT2AMEN1NR4A2IDO1ALDH1A1
SCHEMBL364787 0.84 KMT2A (0.45) KMT2AMEN1NR4A2IDO1ALDH1A1
SCHEMBL364186 0.83 KMT2A (0.44) KMT2AMEN1NR4A2IDO1ALDH1A1
SCHEMBL366737 0.83 IDO1 (0.46) KMT2AMEN1IDO1ALDH1A1GAA
SCHEMBL366858 0.81 KMT2A (0.43) KMT2AMEN1NR4A2IDO1RORC
SCHEMBL365522 0.79 MEN1 (0.41) KMT2AMEN1NR4A2IDO1ALDH1A1
SCHEMBL364927 0.79 SRC (0.51) KMT2AMEN1NR4A2ALDH1A1GAA
SCHEMBL364931 0.79 NR4A2 (0.50) KMT2AMEN1NR4A2IDO1ALDH1A1
SCHEMBL364955 0.78 CASP3 (0.40) KMT2AMEN1NR4A2ALDH1A1GAA

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-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed