SCHEMBL800372

SCHEMBL800372

C[C@H](O)[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)C(F)(F)[C@@H]1O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 2/20 0.41
SLC28A1 O00337 1/20 0.41
SLC28A2 O43868 1/20 0.41
SLC28A3 Q9HAS3 1/20 0.41
POLA1 P09884 1/20 0.41
CYP3A4 P08684 2/20 0.40
CYP2C9 P11712 2/20 0.40
P2RY2 P41231 4/20 0.39
P2RY4 P51582 1/20 0.39
PDE4D Q08499 1/20 0.36
PDE3A Q14432 1/20 0.36
P2RY6 Q15077 2/20 0.35

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
SCHEMBL20427395 1.00 SLC29A1 (0.41) SLC29A1SLC28A1SLC28A2SLC28A3POLA1
SCHEMBL13134626 1.00 SLC29A1 (0.41) SLC29A1SLC28A1SLC28A2SLC28A3POLA1
SCHEMBL800876 0.91 POLA1 (0.44) SLC29A1SLC28A1SLC28A2SLC28A3POLA1
SCHEMBL10492407 0.89 P2RY2 (0.41) SLC29A1SLC28A1SLC28A2SLC28A3POLA1
SCHEMBL3952359 0.89 P2RY2 (0.41) SLC29A1SLC28A1SLC28A2SLC28A3POLA1
SCHEMBL29403438 0.89 P2RY2 (0.41) SLC29A1SLC28A1SLC28A2SLC28A3POLA1
SCHEMBL800274 0.89 POLA1 (0.38) SLC29A1SLC28A1SLC28A2SLC28A3POLA1
SCHEMBL540156 0.89 P2RY2 (0.41) SLC29A1SLC28A1SLC28A2SLC28A3POLA1
SCHEMBL541102 0.89 P2RY2 (0.41) SLC29A1SLC28A1SLC28A2SLC28A3POLA1
SCHEMBL30256684 0.89 P2RY2 (0.41) SLC29A1SLC28A1SLC28A2SLC28A3POLA1

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-20120070411-A1 SUBSTITUTED NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2012-03-22 US disclosed
US-20120070411-A1 SUBSTITUTED NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2012-03-22 US disclosed
US-20100249068-A1 SUBSTITUTED NUCLEOSIDE AND NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2010-09-30 US disclosed
US-20100249068-A1 SUBSTITUTED NUCLEOSIDE AND NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2010-09-30 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 (2 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-20120070411-A1 SUBSTITUTED NUCLEOTIDE ANALOGS PNP, NTPCR, NUDT1 SLC29A1 33/4885SLC28A1 56/4885SLC28A2 64/4885
US-20100249068-A1 SUBSTITUTED NUCLEOSIDE AND NUCLEOTIDE ANALOGS PNP, TYMP, NTPCR SLC29A1 21/4885SLC28A1 45/4885SLC28A2 48/4885

“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.