SCHEMBL21099708

SCHEMBL21099708

C[C@@H](OC(=O)c1ccccc1)[C@H]1O[C@@](C#N)(n2ccc(N)nc2=O)C(OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 1/20 0.31

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
SCHEMBL13471861 1.00 TLR7 (0.31) TLR7
SCHEMBL13470532 0.96 ABCB1 (0.31)
SCHEMBL16214805 0.91 POLB (0.30) TLR7
SCHEMBL13454861 0.86 TRPM8 (0.32)
SCHEMBL13470609 0.83 POLB (0.34) TLR7
SCHEMBL13470531 0.79 ABCB1 (0.34)
SCHEMBL18013096 0.79 MAPT (0.40)
SCHEMBL13470624 0.77 ALDH1A1 (0.35) TLR7
SCHEMBL13470535 0.75 POLB (0.34)
SCHEMBL16730064 0.75 ALDH1A1 (0.40)

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
EP-2697241-B1 1'-SUBSTITUTED PYRIMIDINE N-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES INC (US) 2019-06-12 EP disclosed