SCHEMBL5879824

SCHEMBL5879824

CCCCCc1ccc(S(=O)(=O)Oc2ccccc2/C=N/NC(=O)Cc2cccc(OC)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
SGK1 O00141 1/20 0.47
ALDH1A1 P00352 6/20 0.45
LMNA P02545 4/20 0.44
MAPT P10636 4/20 0.44
HTT P42858 1/20 0.44
KDM4E B2RXH2 3/20 0.43
GAA P10253 2/20 0.43
THRB P10828 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HPGD P15428 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL5879829 1.00 MEN1 (0.52) MEN1KMT2ASGK1ALDH1A1LMNA
SCHEMBL5879972 0.94 MEN1 (0.50) MEN1KMT2ASGK1ALDH1A1LMNA
SCHEMBL5879975 0.94 MEN1 (0.50) MEN1KMT2ASGK1ALDH1A1LMNA
SCHEMBL5880020 0.91 ATM (0.49) MEN1KMT2ASGK1ALDH1A1LMNA
SCHEMBL5880018 0.91 ATM (0.49) MEN1KMT2ASGK1ALDH1A1LMNA
SCHEMBL5879604 0.90 SGK1 (0.52) MEN1KMT2ASGK1ALDH1A1LMNA
SCHEMBL5879600 0.90 SGK1 (0.52) MEN1KMT2ASGK1ALDH1A1LMNA
SCHEMBL5879893 0.89 MEN1 (0.51) MEN1KMT2ASGK1ALDH1A1LMNA
SCHEMBL5879889 0.89 MEN1 (0.51) MEN1KMT2ASGK1ALDH1A1LMNA
SCHEMBL5879750 0.88 MAPT (0.58) MEN1KMT2ASGK1ALDH1A1LMNA

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