SCHEMBL9971018

SCHEMBL9971018

CCCCOc1nc(N)c2[nH]c(=O)n(CCCN(CCCCl)Cc3cccc(CC(=O)OC)c3)c2n1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.73

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
SCHEMBL13798671 0.94 TLR7 (0.71) TLR7
SCHEMBL13798674 0.94 TLR7 (0.71) TLR7
SCHEMBL30164530 0.94 TLR7 (0.71) TLR7
SCHEMBL13798675 0.94 TLR7 (0.70) TLR7
SCHEMBL9936854 0.93 TLR7 (0.62) TLR7
SCHEMBL4139909 0.93 TLR7 (0.79) TLR7
SCHEMBL12048762 0.93 TLR7 (0.71) TLR7
SCHEMBL13798673 0.92 TLR7 (0.68) TLR7
SCHEMBL13798672 0.92 TLR7 (0.68) TLR7
SCHEMBL16256477 0.92 TLR7 (0.68) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651943-B1 PURINE DERIVATIVES SUMITOMO DAINIPPON PHARMA CO LTD (JP) 2017-03-22 EP disclosed
US-8895570-B2 Purine derivatives ASTRAZENECA AB (SE) 2014-11-25 US disclosed
WO-2012080730-A1 PURINE DERIVATIVES ASTRAZENECA AB (SE) 2012-06-21 WO disclosed