SCHEMBL5086049

SCHEMBL5086049

O=P(O)(O)COCCC(COC(c1ccccc1)(c1ccccc1)c1ccccc1)n1cnc2c(NC3CC3)ncnc21

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NT5E P21589 4/20 0.38
ABL1 P00519 5/20 0.38
RIN1 Q13671 3/20 0.38
POLB P06746 2/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
HPRT1 P00492 1/20 0.35
NR2F2 P24468 2/20 0.35
DOT1L Q8TEK3 1/20 0.35
GALR3 O60755 1/20 0.35
SRC P12931 2/20 0.34
FGFR1 P11362 1/20 0.34
SLC22A6 Q4U2R8 1/20 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
SCHEMBL5083618 0.97 NT5E (0.40) NT5EABL1RIN1TAS1R3TAS1R1
SCHEMBL5083530 0.97 NT5E (0.41) NT5EABL1RIN1TAS1R3TAS1R1
SCHEMBL5086381 0.88 DNPH1 (0.40) HPRT1SRCFGFR1SLC22A6
SCHEMBL5083620 0.87 CCNB2 (0.39) NT5EHPRT1FGFR1SLC22A6
SCHEMBL5082994 0.86 ABL1 (0.42) ABL1RIN1NR2F2DOT1LGALR3
SCHEMBL5086065 0.85 ABL1 (0.38) NT5EABL1RIN1HPRT1DOT1L
SCHEMBL5082970 0.82 NR2F2 (0.43) ABL1RIN1NR2F2GALR3
SCHEMBL5083017 0.82 ADORA1 (0.43) ABL1RIN1NR2F2GALR3
SCHEMBL5085981 0.81 HPRT1 (0.37) NT5EHPRT1FGFR1SLC22A6
SCHEMBL6055298 0.77 CCNB2 (0.34)

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
US-7388002-B2 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2008-06-17 US disclosed
US-20060122391-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2006-06-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060122391-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases POLR2H, NSUN2, POLR2E NT5E 1175/4885ABL1 2347/4885RIN1 1635/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.