SCHEMBL7922849

SCHEMBL7922849

O=C[C@@H]1C(COC(c2ccccc2)(c2ccccc2)c2ccccc2)OC(n2ccc(=O)[nH]c2=O)[C@@H]1O

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC28A1 O00337 1/20 0.52
SLC28A2 O43868 1/20 0.52
SLC29A1 Q99808 1/20 0.52
SLC28A3 Q9HAS3 1/20 0.52
P2RY6 Q15077 10/20 0.49
P2RY2 P41231 14/20 0.49
P2RY14 Q15391 3/20 0.49
P2RY4 P51582 4/20 0.48
TYMP P19971 1/20 0.47

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
SCHEMBL6323744 1.00 SLC28A1 (0.52) SLC28A1SLC28A2SLC29A1SLC28A3P2RY6
SCHEMBL6323748 1.00 SLC28A1 (0.52) SLC28A1SLC28A2SLC29A1SLC28A3P2RY6
SCHEMBL7922851 1.00 SLC28A1 (0.52) SLC28A1SLC28A2SLC29A1SLC28A3P2RY6
SCHEMBL4085510 0.90 SLC28A1 (0.62) SLC28A1SLC28A2SLC29A1SLC28A3P2RY6
SCHEMBL8332109 0.90 SLC28A1 (0.62) SLC28A1SLC28A2SLC29A1SLC28A3P2RY6
SCHEMBL2584027 0.86 SLC28A1 (0.52) SLC28A1SLC28A2SLC29A1SLC28A3P2RY6
SCHEMBL3316264 0.85 P2RY14 (0.51) SLC28A1SLC28A2SLC29A1SLC28A3P2RY6
SCHEMBL2580691 0.84 P2RY2 (0.49) SLC28A1SLC28A2SLC29A1SLC28A3P2RY6
SCHEMBL7257091 0.83 TYMP (0.47) TYMP
SCHEMBL7257093 0.83 TYMP (0.47) TYMP

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-6214551-B1 CONTACTING TEST SOLUTION CONTAINING NUCLEIC ACID WITH COMPOUND CONTAINING NUCLEOSIDE SEQUENCE WHEREIN NUCLEOSIDES ARE COVALENTLY BOUND THROUGH LINKING GROUP HAVING ADJACENT NITROGEN ATOMS FOR ASSAYING SEQUENCE-SPECIFIC NUCLEIC ACID ISIS PHARMACEUTICALS, INC. 2001-04-10 US disclosed