SCHEMBL19633673

SCHEMBL19633673

COCCOc1nc(N)c2nc(Br)n(Cc3ccc(C(=O)OOCCOc4nc(N)c5nc(O)n(Cc6ccc(C(=O)O)cc6)c5n4)cc3)c2n1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 16/20 0.48
NUDT1 P36639 1/20 0.42

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
SCHEMBL31126376 0.88 TLR7 (0.59) TLR7NUDT1
SCHEMBL4425489 0.88 TLR7 (0.59) TLR7NUDT1
SCHEMBL21076809 0.85 TLR7 (0.57) TLR7NUDT1
SCHEMBL31126373 0.81 TLR7 (0.57) TLR7NUDT1
SCHEMBL20284131 0.81 TLR7 (0.57) TLR7NUDT1
SCHEMBL20380003 0.81 TLR7 (0.57) TLR7NUDT1
SCHEMBL20647711 0.81 TLR7 (0.52) TLR7NUDT1
SCHEMBL24366833 0.80 TLR7 (0.66) TLR7
SCHEMBL4412350 0.79 TLR7 (0.49) TLR7NUDT1
SCHEMBL20284132 0.79 TLR7 (0.57) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017197624-A1 PURINE-SCAFFOLD TLR7 LIGANDS AND CONJUGATE THEREOF SHENZHEN HORNETCORN BIOTECHNOLOGY COMPANY,CO., LTD (CN) 2017-11-23 WO disclosed