SCHEMBL1506536

SCHEMBL1506536

C[C@@]1(n2cnc3c(=O)[nH]c(N)nc32)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@]1(C)O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.51
NT5E P21589 1/20 0.49
TGM2 P21980 1/20 0.48
TAS1R3 Q7RTX0 2/20 0.48
TAS1R1 Q7RTX1 2/20 0.48
PNP P00491 2/20 0.47
IMPDH2 P12268 6/20 0.47
IMPDH1 P20839 2/20 0.47
POLG P54098 1/20 0.44
FUT5 Q11128 1/20 0.43
P2RY2 P41231 1/20 0.43
P2RY4 P51582 1/20 0.43
P2RY6 Q15077 1/20 0.43
HPRT1 P00492 2/20 0.43
KRAS P01116 1/20 0.42

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
SCHEMBL21105384 0.88 POLB (0.53) POLBNT5ETGM2TAS1R3TAS1R1
SCHEMBL1964956 0.85 TK1 (0.46) PNPHPRT1
SCHEMBL14659959 0.85 NT5E (0.51) POLBNT5ETGM2TAS1R3TAS1R1
SCHEMBL31657782 0.84 POLB (0.52) POLBNT5ETGM2TAS1R3TAS1R1
SCHEMBL2826609 0.83 NT5E (0.53) POLBNT5ETGM2TAS1R3TAS1R1
SCHEMBL1300019 0.82 TAS1R3 (0.56) POLBTAS1R3TAS1R1P2RY2
SCHEMBL29093615 0.82 NT5E (0.52) POLBNT5ETGM2TAS1R3TAS1R1
SCHEMBL31448234 0.82 POLB (0.51) POLBNT5ETGM2TAS1R3TAS1R1
SCHEMBL407396 0.81 NT5E (0.51) POLBNT5ETGM2TAS1R3TAS1R1
SCHEMBL7084738 0.81 TAS1R3 (0.45) POLBNT5ETGM2TAS1R3TAS1R1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2297175-A2 MRNA CAP ANALOGS Uniwersytet Warszawski (PL) 2011-03-23 EP disclosed
WO-2009149253-A2 MRNA CAP ANALOGS UNIWERSYTET WARSZAWSKI (PL) 2009-12-10 WO disclosed