SCHEMBL5880136

SCHEMBL5880136

COc1cccc(CC(=O)N/N=C/c2ccccc2OS(=O)(=O)c2ccc(C(C)=O)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SGK1 O00141 1/20 0.49
LMNA P02545 5/20 0.48
KMT2A Q03164 9/20 0.47
MEN1 O00255 8/20 0.47
MAPT P10636 7/20 0.47
HTT P42858 4/20 0.47
ALDH1A1 P00352 9/20 0.47
GAA P10253 4/20 0.47
KDM4E B2RXH2 3/20 0.43
HPGD P15428 1/20 0.43
EYA2 O00167 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HIF1A Q16665 1/20 0.43

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
SCHEMBL5880141 1.00 SGK1 (0.49) SGK1LMNAKMT2AMEN1MAPT
SCHEMBL5879604 0.93 SGK1 (0.52) SGK1LMNAKMT2AMEN1MAPT
SCHEMBL5879600 0.93 SGK1 (0.52) SGK1LMNAKMT2AMEN1MAPT
SCHEMBL5879754 0.91 MAPT (0.58) SGK1LMNAKMT2AMEN1MAPT
SCHEMBL5879750 0.91 MAPT (0.58) SGK1LMNAKMT2AMEN1MAPT
SCHEMBL5879663 0.90 SGK1 (0.50) SGK1LMNAKMT2AMEN1MAPT
SCHEMBL5879661 0.90 SGK1 (0.50) SGK1LMNAKMT2AMEN1MAPT
SCHEMBL5879972 0.89 MEN1 (0.50) SGK1LMNAKMT2AMEN1MAPT
SCHEMBL5879975 0.89 MEN1 (0.50) SGK1LMNAKMT2AMEN1MAPT
SCHEMBL5879827 0.89 SGK1 (0.52) SGK1LMNAKMT2AMEN1MAPT

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
US-7026339-B2 Inhibitors of HCV NS5B polymerase PFIZER INC. 2006-04-11 US disclosed