SCHEMBL18744091

SCHEMBL18744091

C[C@H]1[C@@H]2OCOC[C@H]2O[C@H]1n1ccc(=O)[nH]c1=O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SLC28A1 O00337 1/20 0.41
▸ SLC28A2 O43868 1/20 0.41
▸ SLC29A1 Q99808 1/20 0.41
▸ SLC28A3 Q9HAS3 1/20 0.41
▸ P2RY2 P41231 11/20 0.37
▸ P2RY6 Q15077 7/20 0.37
▸ STING1 Q86WV6 1/20 0.35
▸ P2RY4 P51582 3/20 0.34

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
SCHEMBL17972446 0.86 P2RY14 (0.35) P2RY2P2RY6P2RY4
SCHEMBL17972448 0.83 SLC28A1 (0.39) SLC28A1SLC28A2SLC29A1SLC28A3P2RY2
SCHEMBL18744090 0.81 SLC28A1 (0.41) SLC28A1SLC28A2SLC29A1SLC28A3P2RY2
SCHEMBL19534593 0.81 SLC28A1 (0.43) SLC28A1SLC28A2SLC29A1SLC28A3P2RY2
SCHEMBL18464130 0.79 SLC28A1 (0.39) SLC28A1SLC28A2SLC29A1SLC28A3P2RY2
SCHEMBL19534460 0.77 STING1 (0.53) SLC28A1SLC28A2SLC29A1SLC28A3STING1
SCHEMBL14946357 0.76 SLC28A1 (0.37) SLC28A1SLC28A2SLC29A1SLC28A3P2RY2
SCHEMBL20056902 0.74 STING1 (0.38) SLC28A1SLC28A2SLC29A1SLC28A3P2RY2
SCHEMBL25400489 0.74 SLC28A1 (0.35) SLC28A1SLC28A2SLC29A1SLC28A3P2RY2
SCHEMBL12170354 0.74 SLC28A1 (0.35) SLC28A1SLC28A2SLC29A1SLC28A3P2RY2

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
US-9624249-B2 Nucleoside kinase bypass compositions and methods MERCK SHARP & DOHME CORP. (US) 2017-04-18 — — US disclosed
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