SCHEMBL1704029

SCHEMBL1704029

Cc1ccc2c(c1)nc(N)c1ncc(CCc3ccc(OCCOCCCP(=O)(O)O)cc3C)cc12

nearest known ligand 0.92

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.92

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
SCHEMBL16735819 1.00 TLR7 (0.92) TLR7
SCHEMBL30575442 0.96 TLR7 (1.00) TLR7
SCHEMBL1527537 0.96 TLR7 (1.00) TLR7
SCHEMBL173521 0.96 TLR7 (1.00) TLR7
SCHEMBL30575438 0.96 TLR7 (1.00) TLR7
SCHEMBL30575432 0.94 TLR7 (0.98) TLR7
SCHEMBL173264 0.94 TLR7 (0.98) TLR7
SCHEMBL1527631 0.93 TLR7 (1.00) TLR7
SCHEMBL170115 0.93 TLR7 (1.00) TLR7
SCHEMBL30575428 0.93 TLR7 (1.00) 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-2268618-B1 COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS NOVARTIS AG (CH) 2015-05-27 EP claimed
EP-2440245-A1 BENZONAPHTHYRIDINE-CONTAINING VACCINES Novartis AG (CH) 2012-04-18 EP disclosed
WO-2010144734-A1 BENZONAPHTHYRIDINE-CONTAINING VACCINES NOVARTIS AG (CH) 2010-12-16 WO disclosed