SCHEMBL10299403

SCHEMBL10299403

CCCCNc1nc(NC)c2nc(O)n(Cc3cccc(CC(=O)OC)c3)c2n1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 18/20 0.49
HDAC1 Q13547 2/20 0.40
HDAC2 Q92769 2/20 0.40

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
SCHEMBL2060059 0.89 TLR7 (0.53) TLR7
SCHEMBL2060539 0.79 TLR7 (0.52) TLR7
SCHEMBL2060216 0.79 TMIGD3 (0.55) TLR7
SCHEMBL5471545 0.79 TLR7 (0.53) TLR7
SCHEMBL12900274 0.77 HDAC1 (0.49) TLR7HDAC1HDAC2
SCHEMBL2060135 0.77 TLR7 (0.71) TLR7
SCHEMBL5459700 0.76 TLR7 (0.54) TLR7
SCHEMBL5471380 0.76 TLR7 (0.49) TLR7
SCHEMBL5459709 0.76 TLR7 (0.75) TLR7
SCHEMBL5468674 0.76 TLR7 (0.67) TLR7

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-1550662-B1 ADENINE COMPOUND AND USE THEREOF DAINIPPON SUMITOMO PHARMA CO (JP) 2012-07-04 EP disclosed