SCHEMBL4556905

SCHEMBL4556905

CCCCOc1nc(N)c2[nH]c(=O)n(CCCc3cc(CNC(=O)CN(C)[C@@H](Cc4ccccc4)C(=O)O)ccc3CC(=O)OC)c2n1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.57
IL6 P05231 5/20 0.46

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
SCHEMBL729313 0.81 TLR7 (0.59) TLR7IL6
SCHEMBL4457811 0.79 TLR7 (0.51) TLR7IL6
SCHEMBL4558355 0.79 TLR7 (0.56) TLR7
SCHEMBL4455886 0.75 TLR7 (0.63) TLR7IL6
SCHEMBL12048828 0.74 TLR7 (0.79) TLR7IL6
SCHEMBL4557594 0.73 TLR7 (0.60) TLR7IL6
SCHEMBL12049043 0.73 TLR7 (0.78) TLR7IL6
SCHEMBL2386909 0.73 TLR7 (0.78) TLR7
SCHEMBL12048693 0.73 TLR7 (0.77) TLR7
SCHEMBL12048683 0.73 TLR7 (0.77) TLR7IL6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2041135-A1 8-OXOADENINE DERIVATIVES ACTING AS MODULATORS OF TLR7 Astra Zeneca AB (SE) 2009-04-01 EP claimed
WO-2008004948-A1 8-OXOADENINE DERIVATIVES ACTING AS MODULATORS OF TLR7 ASTRAZENECA AB (SE) 2008-01-10 WO claimed