SCHEMBL8970004

SCHEMBL8970004

COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(O)[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](OC)[C@]2(O)C[O])cc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 6/20 0.39
P2RY2 P41231 4/20 0.35
P2RY6 Q15077 4/20 0.35
NT5E P21589 1/20 0.35
SLC28A1 O00337 1/20 0.35
SLC28A2 O43868 1/20 0.35
SLC29A1 Q99808 1/20 0.35
SLC28A3 Q9HAS3 1/20 0.35
DUT P33316 2/20 0.35
P2RY4 P51582 2/20 0.34
TYMP P19971 1/20 0.33

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
SCHEMBL9176012 0.81 P2RY14 (0.40) P2RY14P2RY2P2RY6NT5ESLC28A1
SCHEMBL442715 0.78 P2RY14 (0.48) P2RY14P2RY2P2RY6SLC28A1SLC28A2
SCHEMBL8970268 0.77 P2RY14 (0.46) P2RY14P2RY2P2RY6SLC28A1SLC28A2
SCHEMBL8538694 0.77 P2RY14 (0.44) P2RY14P2RY2P2RY6SLC28A1SLC28A2
SCHEMBL9174054 0.77 P2RY14 (0.35) P2RY14P2RY2P2RY6NT5ESLC28A1
SCHEMBL9738798 0.76 DUT (0.39) P2RY14P2RY2P2RY6NT5EDUT
SCHEMBL6832098 0.75 P2RY14 (0.44) P2RY14P2RY2P2RY6SLC28A1SLC28A2
SCHEMBL8210384 0.75 P2RY14 (0.44) P2RY14P2RY2P2RY6SLC28A1SLC28A2
SCHEMBL20603109 0.75 P2RY14 (0.38) P2RY14P2RY2P2RY6NT5ESLC28A1
SCHEMBL5527658 0.73 P2RY14 (0.34) P2RY14NT5EDUT

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-5525719-A N-protected-2'-O-methyl-and N-protected-3'-O-methyl-ribonucleosides and their phosphoramidite derivatives CHEMGENES CORPORATION (US) 1996-06-11 US claimed