SCHEMBL2250902

SCHEMBL2250902

Nc1nc(CC(CO)OCP(=O)(O)O)nc2[nH]cnc12

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.40
SLC22A6 Q4U2R8 1/20 0.39
HPRT1 P00492 9/20 0.36
TYMP P19971 1/20 0.34
CYP3A4 P08684 1/20 0.32

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
SCHEMBL28492789 0.85 CYP3A4 (0.42) HPRT1TYMPCYP3A4
SCHEMBL2824954 0.85 CYP3A4 (0.42) HPRT1TYMPCYP3A4
SCHEMBL30575052 0.82 FGFR1 (0.40) FGFR1SLC22A6HPRT1TYMP
SCHEMBL8400854 0.82 FGFR1 (0.40) FGFR1SLC22A6HPRT1TYMP
SCHEMBL4241346 0.80 CYP3A4 (0.38) FGFR1SLC22A6HPRT1TYMPCYP3A4
SCHEMBL3767291 0.79 FGFR1 (0.37) FGFR1SLC22A6HPRT1TYMP
SCHEMBL16038966 0.76 FGFR1 (0.39) FGFR1SLC22A6HPRT1
SCHEMBL2909563 0.75 PNP (0.35)
SCHEMBL19643046 0.74 FGFR1 (0.37) FGFR1SLC22A6HPRT1
SCHEMBL6334774 0.74 HPRT1 (0.34) FGFR1SLC22A6HPRT1CYP3A4

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-7994143-B2 Metabolically stable alkoxyalkyl esters of antiviral or antiproliferative phosphonates, nucleoside phosphonates and nucleoside phosphates CHIMERIX, INC. (US) 2011-08-09 US disclosed
US-20100249056-A1 Metabolically Stable Alkoxyalkyl Esters of Antiviral or Antiproliferative Phosphonates, Nucleoside Phosphonates and Nucleoside Phosphates CHIMERIX, INC. (US) 2010-09-30 US disclosed
US-7749983-B2 Metabolically stable alkoxyalkyl esters of antiviral or antiproliferative phosphonates, nucleoside phosphonates and nucleoside phosphates CHIMERIX, INC. (US) 2010-07-06 US disclosed
US-20080009462-A1 Metabolically Stable Alkoxyalkyl Esters of Antiviral or Antiproliferative Phosphonates, Nucleoside Phosphonates and Nucleoside Phosphates CHIMERIX, INC. (US) 2008-01-10 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-20100249056-A1 Metabolically Stable Alkoxyalkyl Esters of Antiviral or Antiproliferative Phosphonates, Nucleoside Phosphonates and Nucleoside Phosphates PNP, TYMP, ENPP1 FGFR1 1036/4885SLC22A6 1414/4885HPRT1 183/4885
US-20080009462-A1 Metabolically Stable Alkoxyalkyl Esters of Antiviral or Antiproliferative Phosphonates, Nucleoside Phosphonates and Nucleoside Phosphates PNP, TYMP, ENPP1 FGFR1 1036/4885SLC22A6 1414/4885HPRT1 183/4885

“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.