SCHEMBL29280336

SCHEMBL29280336

C[C@@]1(N2CC(=O)C(=O)NC2=O)O[C@H](CO)[C@@H](O)[C@H]1O.C[C@@]1(n2ccc(=O)[nH]c2=S)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC28A1 O00337 1/20 0.34
SLC28A2 O43868 1/20 0.34
SLC29A1 Q99808 1/20 0.34
SLC28A3 Q9HAS3 1/20 0.34
P2RY14 Q15391 4/20 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
SCHEMBL6028061 0.87 SLC28A1 (0.42) SLC28A1SLC28A2SLC29A1SLC28A3P2RY14
Hydrogen Sulfide SCHEMBL28043634 0.86 SLC28A1 (0.41) SLC28A1SLC28A2SLC29A1SLC28A3P2RY14
SCHEMBL29110859 0.84 PYGB (0.36)
Uridine SCHEMBL29002260 0.79 SLC28A1 (0.64) SLC28A1SLC28A2SLC29A1SLC28A3P2RY14
Taurine SCHEMBL28119150 0.77 SLC28A1 (0.35) SLC28A1SLC28A2SLC29A1SLC28A3P2RY14
SCHEMBL6002015 0.76 SLC28A1 (0.50) SLC28A1SLC28A2SLC29A1SLC28A3P2RY14
SCHEMBL12658269 0.76 SLC28A1 (0.50) SLC28A1SLC28A2SLC29A1SLC28A3P2RY14
SCHEMBL42133 0.76 SLC28A1 (0.50) SLC28A1SLC28A2SLC29A1SLC28A3P2RY14
Hydrogen Sulfide SCHEMBL28043850 0.75 SLC28A1 (0.49) SLC28A1SLC28A2SLC29A1SLC28A3P2RY14
Ammonia Solution, Strong SCHEMBL28145131 0.75 SLC28A1 (0.49) SLC28A1SLC28A2SLC29A1SLC28A3P2RY14

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
CN-117731769-A Nucleic acid vaccine for Varicella Zoster Virus (VZV) 摩登纳特斯有限公司 2024-03-22 CN disclosed