SCHEMBL5484735

SCHEMBL5484735

CC(=O)Nc1nc(C)c(-c2csc(NCCC(=O)O)n2)s1.CC(=O)Nc1nc(C)c(-c2csc(NCCc3nnc(O)o3)n2)s1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 10/20 0.67
PI4KB Q9UBF8 6/20 0.61
ALDH1A1 P00352 3/20 0.54
MAPT P10636 3/20 0.54
KDM4E B2RXH2 2/20 0.54
HTT P42858 2/20 0.54
HSD17B10 Q99714 2/20 0.54
HPGD P15428 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
USP2 O75604 1/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
GFER P55789 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL4521807 0.95 PIK3CG (0.73) PIK3CGPI4KBALDH1A1MAPTKDM4E
SCHEMBL4525099 0.89 PIK3CG (0.66) PIK3CGPI4KBALDH1A1MAPTKDM4E
SCHEMBL4513836 0.87 PIK3CG (0.81) PIK3CGPI4KBALDH1A1MAPTKDM4E
SCHEMBL4519422 0.81 PI4KB (0.79) PIK3CGPI4KBALDH1A1MAPTKDM4E
SCHEMBL5427675 0.78 PIK3CG (1.00) PIK3CGPI4KBALDH1A1MAPTKDM4E
SCHEMBL4530751 0.77 MAPT (0.81) PIK3CGPI4KBALDH1A1MAPTKDM4E
SCHEMBL4528890 0.77 PIK3CG (0.78) PIK3CGPI4KBALDH1A1MAPTKDM4E
SCHEMBL4528106 0.77 PI4KB (1.00) PIK3CGPI4KBALDH1A1MAPTKDM4E
SCHEMBL4523621 0.77 PI4KB (0.71) PIK3CGPI4KBALDH1A1MAPTKDM4E
SCHEMBL4512892 0.76 PIK3CG (1.00) PIK3CGPI4KBALDH1A1MAPTKDM4E

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-1709019-B1 THIAZOLE DERIVATIVES AND USE THEREOF APPLIED RESEARCH SYSTEMS (AN) 2007-08-08 EP claimed