SCHEMBL4913697

SCHEMBL4913697

Cc1nc(O)c(O)c(C(=O)O)n1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.41
ERCC1 P07992 2/20 0.37
FEN1 P39748 2/20 0.37
ERCC4 Q92889 2/20 0.37
RNASEH1 O60930 2/20 0.34
HCAR2 Q8TDS4 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
TSHR P16473 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PIN1 Q13526 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
SCHEMBL2743303 0.82 EGLN1 (0.37) EGLN1ERCC1FEN1ERCC4HCAR2
SCHEMBL7824207 0.78 HCAR2 (0.42) EGLN1HCAR2ALDH1A1MAPTSMN1; SMN2
SCHEMBL12472147 0.77 NPSR1 (0.52) EGLN1ERCC1FEN1ERCC4RNASEH1
SCHEMBL5477906 0.75 ALDH1A1 (0.40) EGLN1HCAR2ALDH1A1HPGDTSHR
SCHEMBL7515527 0.75 HCAR2 (0.38) EGLN1HCAR2ALDH1A1
SCHEMBL11100217 0.74
SCHEMBL9589868 0.73 HCAR2 (0.32) EGLN1ERCC1FEN1ERCC4HCAR2
SCHEMBL15082052 0.70 EGLN1 (0.42) EGLN1HCAR2ALDH1A1HPGDTSHR
SCHEMBL18305810 0.69 ALDH1A1 (0.39) EGLN1ERCC1FEN1ERCC4RNASEH1
SCHEMBL13788790 0.68 PDE10A (0.36) EGLN1ERCC1FEN1ERCC4RNASEH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080153783-A1 Pyrimidyl Phosphonate Antiviral Compounds and Methods of Use GILEAD SCIENCES, INC. (US) 2008-06-26 US disclosed
US-20080076738-A1 Phosphonate Analogs Of Hiv Integrase Inhibitor Compounds GILEAD SCIENCES, INC. 2008-03-27 US disclosed
CN-1934093-A Pyrimidyl phosphonate antiviral compounds and methods of use GILEAD SCIENCES INC (US) 2007-03-21 CN disclosed
EP-1742642-A2 PHOSPHONATE ANALOGS OF HIV INTEGRASE INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2007-01-17 EP disclosed
US-20060116356-A1 Phosphonate analogs of HIV integrase inhibitor compounds GILEAD SCIENCES, INC. 2006-06-01 US disclosed
US-20050282839-A1 Pyrimidyl phosphonate antiviral compounds and methods of use GILEAD SCIENCES, INC. 2005-12-22 US disclosed
WO-2005117904-A2 PHOSPHONATE ANALOGS OF HIV INTEGRASE INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2005-12-15 WO 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 (4 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-20080153783-A1 Pyrimidyl Phosphonate Antiviral Compounds and Methods of Use TYMP, MTAP, PNP EGLN1 2675/4885ERCC1 1162/4885FEN1 86/4885
US-20050282839-A1 Pyrimidyl phosphonate antiviral compounds and methods of use TYMP, MTAP, PNP EGLN1 2675/4885ERCC1 1162/4885FEN1 86/4885
US-20060116356-A1 Phosphonate analogs of HIV integrase inhibitor compounds TYMP, PNP, PIKFYVE EGLN1 3167/4885ERCC1 879/4885FEN1 60/4885
US-20080076738-A1 Phosphonate Analogs Of Hiv Integrase Inhibitor Compounds TYMP, PNP, PIKFYVE EGLN1 3167/4885ERCC1 879/4885FEN1 60/4885

“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.