SCHEMBL4466855

SCHEMBL4466855

NC(=O)Cc1ccc(S(=O)(=O)Nc2nc3ccccc3nc2Nc2cccc(S(N)(=O)=O)c2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.71
KDM4E B2RXH2 7/20 0.71
MEN1 O00255 10/20 0.57
KMT2A Q03164 10/20 0.57
GAA P10253 6/20 0.57
ALDH1A1 P00352 3/20 0.57
HPGD P15428 3/20 0.57
CDC25A P30304 1/20 0.56
CDC25B P30305 1/20 0.56
CTNNB1 P35222 1/20 0.55
L3MBTL1 Q9Y468 2/20 0.54
LMNA P02545 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
HTT P42858 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
POLB P06746 3/20 0.52
RECQL P46063 1/20 0.52
GLA P06280 1/20 0.51
MAPK1 P28482 1/20 0.51
TTR P02766 1/20 0.50

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
SCHEMBL4564728 0.89 MAPT (0.68) MAPTKDM4EMEN1KMT2AGAA
SCHEMBL1790540 0.86 MAPT (0.76) MAPTKDM4EMEN1KMT2AGAA
SCHEMBL1793496 0.85 MAPT (0.76) MAPTKDM4EMEN1KMT2AGAA
SCHEMBL1792529 0.83 CDC25A (0.79) MAPTKDM4EMEN1KMT2AGAA
SCHEMBL1795007 0.83 MAPT (0.72) MAPTKDM4EMEN1KMT2AGAA
SCHEMBL1795886 0.83 MAPT (1.00) MAPTKDM4EMEN1KMT2AGAA
SCHEMBL1791400 0.78 MEN1 (0.86) MAPTKDM4EMEN1KMT2AGAA
SCHEMBL13452150 0.78 MEN1 (0.70) MAPTKDM4EMEN1KMT2AGAA
SCHEMBL1791643 0.77 MAPT (0.76) MAPTKDM4EMEN1KMT2AGAA
SCHEMBL4342354 0.77 PIK3CG (0.64) MAPTKDM4EMEN1KMT2AALDH1A1

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
WO-2009017838-A2 COMBINATIONS OF JAK-2 INHIBITORS AND OTHER AGENTS EXELIXIS, INC. (US) 2009-02-05 WO claimed