SCHEMBL14944686

SCHEMBL14944686

Cc1ccc(CN2CNc3c(N)nc(-c4nc(C5CC5)c[nH]4)nc32)cn1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 8/20 0.33
ADORA1 P30542 4/20 0.32
CHRM1 P11229 1/20 0.32

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
SCHEMBL16206182 0.76 TLR7 (0.54) TLR7ADORA1
SCHEMBL14944753 0.75 USP1 (0.39) TLR7ADORA1
SCHEMBL19423858 0.67 CCR5 (0.31) TLR7
SCHEMBL14944658 0.66 TLR7 (0.36) TLR7ADORA1
SCHEMBL20343744 0.66 TLR7 (0.32) TLR7ADORA1
SCHEMBL16206185 0.65 TLR7 (0.61) TLR7
SCHEMBL28184098 0.61 MAPK1 (0.39) TLR7
SCHEMBL20343748 0.59 GSK3A (0.43) TLR7
SCHEMBL19423898 0.59 GSK3B (0.32) TLR7
SCHEMBL28183235 0.58 MAPK1 (0.38) 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
WO-2013068438-A1 PURINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN R&D IRELAND (IE) 2013-05-16 WO disclosed