SCHEMBL27249641

SCHEMBL27249641

CC[P@](C)(=O)c1nc(N)c2[nH]c(=O)n(Cc3ccc(OCCN(C)C)nc3)c2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 1.00
IL6 P05231 5/20 0.51

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
SCHEMBL30747687 1.00 TLR7 (1.00) TLR7IL6
SCHEMBL27249640 1.00 TLR7 (1.00) TLR7IL6
SCHEMBL30747764 1.00 TLR7 (1.00) TLR7IL6
SCHEMBL30747804 0.92 TLR7 (0.85) TLR7IL6
SCHEMBL27249516 0.92 TLR7 (0.85) TLR7IL6
SCHEMBL1146385 0.85 TLR7 (0.74) TLR7IL6
SCHEMBL30323751 0.85 TLR7 (0.74) TLR7IL6
SCHEMBL30747776 0.85 TLR7 (0.88) TLR7
SCHEMBL30747810 0.85 TLR7 (0.88) TLR7
SCHEMBL27249637 0.85 TLR7 (0.88) 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-2024013205-A1 PHOSPHORYLPURINONE COMPOUNDS FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2024-01-18 WO disclosed