SCHEMBL31126604

SCHEMBL31126604

COc1nc2c(N)nc(OCCO)nc2n1Cc1ccc(F)c(CP(=O)(OC)OC)c1

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 20/20 0.44

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
SCHEMBL31126568 0.94 TLR7 (0.45) TLR7
SCHEMBL31126543 0.91 TLR7 (0.45) TLR7
SCHEMBL31126582 0.91 TLR7 (0.45) TLR7
SCHEMBL31126564 0.86 TLR7 (0.51) TLR7
SCHEMBL31126558 0.86 TLR7 (0.45) TLR7
SCHEMBL31126539 0.83 TLR7 (0.42) TLR7
SCHEMBL31126631 0.83 TLR7 (0.45) TLR7
SCHEMBL31126601 0.83 TLR7 (0.51) TLR7
SCHEMBL31126609 0.83 TLR7 (0.45) TLR7
SCHEMBL31126569 0.79 TLR7 (0.45) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024199063-A1 PHOSPHORUS OR SULFUR-CONTAINING MACROCYCLE AND USE THEREOF 浙江养生堂天然药物研究所有限公司 2024-10-03 — — WO disclosed
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