SCHEMBL3265202

SCHEMBL3265202

CCCCNc1nc(N)c2[nH]c(=O)n(CCCNC[C@H]3CCCO3)c2n1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.57

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
SCHEMBL1951660 1.00 TLR7 (0.57) TLR7
SCHEMBL1920227 0.92 TLR7 (0.59) TLR7
SCHEMBL2197538 0.90 TLR7 (0.65) TLR7
SCHEMBL1952355 0.90 TLR7 (0.60) TLR7
SCHEMBL2198427 0.89 TLR7 (0.69) TLR7
SCHEMBL2198099 0.89 TLR7 (0.61) TLR7
SCHEMBL2199312 0.88 TLR7 (0.66) TLR7
SCHEMBL2201462 0.87 TLR7 (0.68) TLR7
SCHEMBL2196903 0.87 TLR7 (0.70) TLR7
SCHEMBL1919984 0.87 TLR7 (0.61) 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-2010018130-A1 PURINE DERIVATIVES FOR USE IN THE TREATMENT OF ALLERGIC, INFLAMMATORY AND INFECTIOUS DISEASES SMITHKLINE BEECHAM CORPORATION (US) 2010-02-18 WO disclosed