SCHEMBL10819909

SCHEMBL10819909

CC1(O)C(O)[C@@H](COP(=O)(O)O)O[C@H]1n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NT5E P21589 1/20 0.57
POLB P06746 1/20 0.56
IMPDH2 P12268 6/20 0.54
TAS1R3 Q7RTX0 2/20 0.54
TAS1R1 Q7RTX1 2/20 0.54
IMPDH1 P20839 2/20 0.54
TGM2 P21980 1/20 0.53
FUT5 Q11128 1/20 0.50
KRAS P01116 3/20 0.49
P2RY2 P41231 2/20 0.49
P2RY4 P51582 2/20 0.49
HINT1 P49773 1/20 0.49
ADORA2A P29274 1/20 0.48
P2RY6 Q15077 1/20 0.48

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
SCHEMBL1577230 1.00 NT5E (0.57) NT5EPOLBIMPDH2TAS1R3TAS1R1
SCHEMBL12939473 1.00 NT5E (0.57) NT5EPOLBIMPDH2TAS1R3TAS1R1
SCHEMBL12194800 1.00 NT5E (0.57) NT5EPOLBIMPDH2TAS1R3TAS1R1
SCHEMBL15468735 1.00 NT5E (0.57) NT5EPOLBIMPDH2TAS1R3TAS1R1
SCHEMBL18740412 0.96 NT5E (0.53) NT5EPOLBIMPDH2TAS1R3TAS1R1
SCHEMBL723267 0.94 NT5E (0.56) NT5EPOLBIMPDH2TAS1R3TAS1R1
SCHEMBL1576874 0.93 TGM2 (0.59) NT5EPOLBIMPDH2TAS1R3TAS1R1
SCHEMBL13522449 0.93 TGM2 (0.59) NT5EPOLBIMPDH2TAS1R3TAS1R1
SCHEMBL10819892 0.93 TGM2 (0.59) NT5EPOLBIMPDH2TAS1R3TAS1R1
Inx-09114 SCHEMBL23319265 0.92 P2RY2 (0.60) NT5EPOLBIMPDH2TAS1R3TAS1R1

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-20120251487-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF VIRAL INFECTIONS IDENIX PHARMACEUTICALS LLC 2012-10-04 US disclosed
EP-2476690-A1 Compounds and pharmaceutical compositions for the treatment of viral infections IDENIX Pharmaceuticals, Inc. (US) 2012-07-18 EP disclosed
US-20110243886-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF VIRAL INFECTIONS SURLERAUX DOMINIQUE 2011-10-06 US disclosed
WO-2010014134-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF VIRAL INFECTIONS IDENIX PHARAMACEUTICALS, INC. (US) 2010-02-04 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 (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-20110243886-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF VIRAL INFECTIONS HAVCR2, PYGL, EIF2AK2 NT5E 684/4885POLB 328/4885IMPDH2 479/4885
US-20120251487-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF VIRAL INFECTIONS HAVCR2, PYGL, EIF2AK2 NT5E 684/4885POLB 328/4885IMPDH2 479/4885

“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.