SCHEMBL14944705

SCHEMBL14944705

Cc1cccc(Cn2c(=O)[nH]c3c(N)nc(-c4ccn[nH]4)nc32)[n+]1[O-]

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 19/20 0.44
NUDT1 P36639 1/20 0.38

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
SCHEMBL20343764 0.90 TLR7 (0.45) TLR7
SCHEMBL14944625 0.80 TLR7 (0.62) TLR7NUDT1
SCHEMBL14944719 0.77 TLR7 (0.48) TLR7
SCHEMBL14944721 0.76 TLR7 (0.52) TLR7
SCHEMBL14944720 0.75 TLR7 (0.67) TLR7
SCHEMBL20343745 0.73 TLR7 (0.56) TLR7
SCHEMBL14944706 0.72 TLR7 (0.42) TLR7NUDT1
SCHEMBL20343738 0.68 TLR7 (0.38) TLR7
SCHEMBL14944703 0.68 TLR7 (0.65) TLR7NUDT1
SCHEMBL14944694 0.64 TLR7 (0.63) TLR7NUDT1

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-2776439-B1 PURINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN SCIENCES IRELAND UC (IE) 2018-07-04 EP disclosed
WO-2013068438-A1 PURINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN R&D IRELAND (IE) 2013-05-16 WO disclosed