SCHEMBL4792602

SCHEMBL4792602

CCCCc1nc2cnc3ccccc3c2n1CC1CCOCC1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 17/20 0.69
TLR8 Q9NR97 1/20 0.61
PIK3CD O00329 1/20 0.44
PIK3CA P42336 1/20 0.44
MTOR P42345 1/20 0.44
BRD4 O60885 1/20 0.43
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 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
SCHEMBL14465845 0.94 TLR7 (0.60) TLR7TLR8PIK3CDPIK3CAMTOR
SCHEMBL14466847 0.89 TLR7 (0.54) TLR7TLR8PIK3CDPIK3CAMTOR
SCHEMBL14466065 0.87 TLR7 (0.62) TLR7TLR8PIK3CDPIK3CAMTOR
Hydrochloric Acid SCHEMBL4761666 0.86 TLR7 (0.61) TLR7TLR8PIK3CDPIK3CAMTOR
SCHEMBL4789693 0.85 TLR7 (0.49) TLR7TLR8PIK3CDPIK3CAMTOR
SCHEMBL2059234 0.85 TLR7 (0.49) TLR7TLR8PIK3CDPIK3CAMTOR
SCHEMBL4762704 0.85 TLR7 (0.49) TLR7TLR8PIK3CDPIK3CAMTOR
SCHEMBL4763092 0.84 TLR7 (0.62) TLR7TLR8PIK3CDPIK3CAMTOR
SCHEMBL4791173 0.84 BRD4 (0.59) TLR7TLR8PIK3CDPIK3CAMTOR
SCHEMBL5160131 0.84 TLR7 (0.54) TLR7TLR8BRD4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1968587-A1 SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZONAPHTHYRIDINES, AND IMIDAZOPYRIDINES, COMPOSITIONS, AND METHODS Coley Pharmaceutical, Inc. (US) 2008-09-17 EP disclosed
WO-2007075468-A1 SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZONAPHTHYRIDINES, AND IMIDAZOPYRIDINES, COMPOSITIONS, AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-07-05 WO disclosed
WO-2007075468-A1 SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZONAPHTHYRIDINES, AND IMIDAZOPYRIDINES, COMPOSITIONS, AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-07-05 WO disclosed