SCHEMBL29606142

SCHEMBL29606142

CCOCc1nc2c(N)nc3c(c2n1CC(C)(CO)CO)CCCC3

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 18/20 0.47
TLR8 Q9NR97 15/20 0.47
NUDT1 P36639 2/20 0.47

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
SCHEMBL22898779 1.00 TLR7 (0.47) TLR7TLR8NUDT1
SCHEMBL22898723 0.99 TLR7 (0.48) TLR7TLR8NUDT1
Formic Acid SCHEMBL27211547 0.95 TLR7 (0.43) TLR7TLR8NUDT1
SCHEMBL29606013 0.90 TLR7 (0.41) TLR7TLR8NUDT1
SCHEMBL27211546 0.90 TLR7 (0.41) TLR7TLR8NUDT1
SCHEMBL1538304 0.89 TLR7 (0.59) TLR7TLR8NUDT1
Water SCHEMBL29421423 0.88 TLR7 (0.58) TLR7TLR8NUDT1
Water SCHEMBL622142 0.88 TLR7 (0.58) TLR7TLR8NUDT1
SCHEMBL22898710 0.84 TLR7 (0.46) TLR7TLR8
SCHEMBL29605457 0.84 TLR7 (0.46) TLR7TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114364677-B Imidazo [4,5-C ] pyridine derivatives as TOLL-like receptor agonists 辉瑞公司 2024-07-09 CN claimed
EP-3999507-A1 IMIDAZO[4,5-C]PYRIDINE DERIVATIVES AS TOLL-LIKE RECEPTOR AGONISTS Pfizer Inc. (US) 2022-05-25 EP claimed
CN-114364677-A Imidazo [4,5-C ] pyridine derivatives as TOLL-like receptor agonists 辉瑞公司 2022-04-15 CN claimed
CN-114364677-B Imidazo [4,5-C ] pyridine derivatives as TOLL-like receptor agonists 辉瑞公司 2024-07-09 CN disclosed
EP-3999507-A1 IMIDAZO[4,5-C]PYRIDINE DERIVATIVES AS TOLL-LIKE RECEPTOR AGONISTS Pfizer Inc. (US) 2022-05-25 EP disclosed
CN-114364677-A Imidazo [4,5-C ] pyridine derivatives as TOLL-like receptor agonists 辉瑞公司 2022-04-15 CN disclosed