SCHEMBL2582514

SCHEMBL2582514

O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@@H](I)[C@H]2O)cc1-c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 6/20 0.64
PYGM P11217 3/20 0.55
TK2 O00142 3/20 0.54
TYMS P04818 1/20 0.49
SLC28A1 O00337 1/20 0.49
SLC28A2 O43868 1/20 0.49
SLC29A1 Q99808 1/20 0.49
SLC28A3 Q9HAS3 1/20 0.49

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
SCHEMBL2582516 1.00 P2RY2 (0.64) P2RY2PYGMTK2TYMSSLC28A1
SCHEMBL2582512 1.00 P2RY2 (0.64) P2RY2PYGMTK2TYMSSLC28A1
SCHEMBL2587308 0.91 P2RY2 (0.61) P2RY2PYGMTK2TYMSSLC28A1
SCHEMBL2587314 0.91 P2RY2 (0.61) P2RY2PYGMTK2TYMSSLC28A1
SCHEMBL2587311 0.91 P2RY2 (0.61) P2RY2PYGMTK2TYMSSLC28A1
SCHEMBL28937870 0.90 P2RY2 (0.74) P2RY2PYGMTK2TYMSSLC28A1
SCHEMBL2577658 0.90 P2RY2 (0.74) P2RY2PYGMTK2TYMSSLC28A1
SCHEMBL2583670 0.86 P2RY2 (0.64) P2RY2PYGMTK2TYMSSLC28A1
SCHEMBL2582365 0.84 PYGM (0.52) P2RY2PYGMTK2SLC28A1SLC28A2
SCHEMBL2582367 0.84 PYGM (0.52) P2RY2PYGMTK2SLC28A1SLC28A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10100076-B2 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation GILEAD PHARMASSET LLC (US) 2018-10-16 US disclosed
US-20140057863-A1 MODIFIED NUCLEOSIDES FOR THE TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION GILEAD SCIENCES, INC. (US) 2014-02-27 US disclosed
US-20110269707-A1 Modified nucleosides for the treatment of viral infections and abnormal cellullar proliferation PHARMASSET, INC. 2011-11-03 US disclosed
EP-1411954-B1 MODIFIED NUCLEOSIDES FOR TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION PHARMASSET INC (US) 2010-12-15 EP disclosed
EP-2251015-A1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation Pharmasset, Inc. (US) 2010-11-17 EP disclosed
US-20030087873-A1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation PHARMASSET, INC. 2003-05-08 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 (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-20140057863-A1 MODIFIED NUCLEOSIDES FOR THE TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION SLC29A1, PNP, SLC29A2 P2RY2 351/4885PYGM 89/4885TK2 149/4885
US-20110269707-A1 Modified nucleosides for the treatment of viral infections and abnormal cellullar proliferation PNP, ALPP, XDH P2RY2 492/4885PYGM 4/4885TK2 261/4885
US-10100076-B2 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation SLC29A1, SLC29A2, PNP P2RY2 554/4885PYGM 99/4885TK2 159/4885
US-20030087873-A1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation SLC29A1, PNP, SLC29A2 P2RY2 427/4885PYGM 72/4885TK2 190/4885

“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.