SCHEMBL5083006

SCHEMBL5083006

CC(C)(C)C(=O)OCCC(CO)n1cnc2c(N)ncnc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHCY P23526 3/20 0.51
ABCB11 O95342 1/20 0.48
POLA1 P09884 1/20 0.48
POLG P54098 1/20 0.48
FAP Q12884 1/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
ADORA2A P29274 2/20 0.46
ADORA2B P29275 2/20 0.46
ADORA1 P30542 2/20 0.46
PI4KA P42356 1/20 0.46
PI4K2B Q8TCG2 1/20 0.46
PI4K2A Q9BTU6 1/20 0.46
PI4KB Q9UBF8 1/20 0.46
ADA P00813 4/20 0.43
PDE2A O00408 2/20 0.43
CYP3A4 P08684 2/20 0.43
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43

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
SCHEMBL5086022 0.86 ABCB11 (0.44) AHCYABCB11POLA1POLGFAP
SCHEMBL14175392 0.82 ABCB11 (0.42) AHCYABCB11POLA1POLGFAP
SCHEMBL14175401 0.79 FAP (0.68) AHCYABCB11POLA1POLGFAP
SCHEMBL8352543 0.78 ADORA2A (0.63) AHCYADORA2AADORA2BADORA1PI4KA
SCHEMBL6316076 0.77 FGFR1 (0.61) AHCYSLC22A6ADORA2AADORA2BADORA1
SCHEMBL5082281 0.77 FGFR1 (0.46) AHCYABCB11POLA1POLGFAP
SCHEMBL5080083 0.75 FDPS (0.37) AHCYABCB11POLA1POLGFAP
SCHEMBL5086028 0.75 PDE2A (0.42) ADAPDE2ACYP3A4PDE4APDE4B
SCHEMBL5441541 0.75 ADA (0.69) ADORA2AADORA2BADORA1PI4KAPI4K2B
SCHEMBL14175409 0.74 ABCB11 (0.34) AHCYABCB11POLA1POLGFAP

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 4 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-7388002-B2 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2008-06-17 US disclosed
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 AHCY 2333/4885ABCB11 1989/4885POLA1 76/4885

“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.