SCHEMBL8339183

SCHEMBL8339183

CNCc1ccccc1C(=O)NC

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.53
HPGD P15428 5/20 0.50
LMNA P02545 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
PLK1 P53350 1/20 0.50
HTT P42858 1/20 0.46
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 1/20 0.45
KAT2B Q92831 1/20 0.43
BAZ2B Q9UIF8 1/20 0.43
BRD4 O60885 1/20 0.43
BRD2 P25440 1/20 0.43
BRD3 Q15059 1/20 0.43
BRDT Q58F21 1/20 0.43
POLB P06746 1/20 0.43
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42
BCAT2 O15382 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
SCHEMBL5954191 0.84 GAA (0.57) GAAHPGDLMNAL3MBTL1PLK1
SCHEMBL3130427 0.82 HIF1A (0.54) GAAHPGDLMNAL3MBTL1HTT
SCHEMBL6868432 0.82 HPGD (0.66) GAAHPGDLMNAL3MBTL1PLK1
SCHEMBL14429809 0.82 HPGD (0.43) GAAHPGDLMNAL3MBTL1HTT
Hydrochloric Acid SCHEMBL29444036 0.81 HIF1A (0.53) GAAHPGDLMNAL3MBTL1HTT
SCHEMBL16597336 0.81 GAA (0.53) GAAHPGDLMNAL3MBTL1PLK1
SCHEMBL4019795 0.81 HPGD (0.45) HPGDALDH1A1KDM4EBRD4BCAT2
SCHEMBL4763592 0.81 GAA (0.53) GAAHPGDLMNAL3MBTL1PLK1
SCHEMBL17629659 0.81 GAA (0.53) GAAHPGDLMNAL3MBTL1PLK1
SCHEMBL19495003 0.81 SLC6A4 (0.42) GAAHPGDLMNAL3MBTL1HTT

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-2004024728-A2 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-03-25 WO disclosed