SCHEMBL29507673

SCHEMBL29507673

CCOCc1nc2c(N)nc3cc(-c4cccnc4)ccc3c2n1C(=O)C(C)(C)O

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 18/20 0.49
▸ TLR8 Q9NR97 12/20 0.49
▸ NUDT1 P36639 1/20 0.47
▸ DHFR P00374 1/20 0.42
▸ NLRP3 Q96P20 1/20 0.40

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
SCHEMBL29373958 0.85 TLR7 (0.69) TLR7TLR8NUDT1
SCHEMBL3862215 0.85 TLR7 (0.69) TLR7TLR8NUDT1
SCHEMBL3868448 0.82 TLR7 (0.58) TLR7TLR8NUDT1DHFR
SCHEMBL3861997 0.80 TLR8 (0.57) TLR7TLR8NUDT1DHFR
SCHEMBL3867967 0.80 TLR7 (0.53) TLR7TLR8NUDT1
SCHEMBL29507665 0.80 TLR7 (0.50) TLR7TLR8NLRP3
SCHEMBL3866064 0.79 TLR7 (0.68) TLR7TLR8NUDT1DHFR
SCHEMBL6105785 0.79 TLR7 (0.50) TLR7TLR8NUDT1
SCHEMBL13645600 0.79 TLR7 (0.56) TLR7TLR8NUDT1NLRP3
SCHEMBL3863711 0.79 TLR7 (0.53) TLR7TLR8NUDT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230381350-A1 ANTIBODY FRAGMENT AGAINST FAP PRECIRIX N.V. (BE) 2023-11-30 — — US disclosed
WO-2023213801-A1 PRE-TARGETING PRECIRIX N.V. (BE) 2023-11-09 — — WO disclosed
WO-2023203135-A1 IMPROVED RADIOLABELLED ANTIBODY PRECIRIX N.V. (BE) 2023-10-26 — — WO disclosed
EP-4211171-A2 ANTIBODY FRAGMENT AGAINST FAP Precirix N.V. (BE) 2023-07-19 — — EP disclosed
WO-2022053651-A2 ANTIBODY FRAGMENT AGAINST FAP PRECIRIX N.V. (BE) 2022-03-17 — — WO disclosed
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