SCHEMBL2587843

SCHEMBL2587843

CCc1cn([C@@H]2O[C@H](COC(C)=O)C[C@H]2OC(C)=O)c(=O)nc1NC(=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
ABL1 P00519 1/20 0.37
RIN1 Q13671 1/20 0.37
P2RY6 Q15077 4/20 0.37
P2RY14 Q15391 2/20 0.37
NT5E P21589 1/20 0.35
HTT P42858 2/20 0.34
ABCB1 P08183 4/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TRIP13 Q15645 1/20 0.33

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
SCHEMBL2577864 0.94 POLB (0.38) POLBABL1RIN1P2RY6P2RY14
SCHEMBL2585789 0.93 POLB (0.38) POLBABL1RIN1P2RY6P2RY14
SCHEMBL2586190 0.92 POLB (0.41) POLBABL1RIN1P2RY6P2RY14
SCHEMBL2577663 0.91 TRIP13 (0.37) POLBKDM4EALDH1A1TRIP13
SCHEMBL2583915 0.89 POLB (0.42) POLBABL1RIN1P2RY6P2RY14
SCHEMBL2578179 0.89 POLB (0.39) POLBABL1RIN1P2RY6P2RY14
SCHEMBL2583162 0.87 ADORA3 (0.38) POLBTRIP13
SCHEMBL2586912 0.86 LMNA (0.33) ALDH1A1
SCHEMBL2578182 0.86 TRIP13 (0.36) POLBKDM4EALDH1A1TRIP13
SCHEMBL2577572 0.84 POLB (0.55) POLBABL1RIN1P2RY6P2RY14

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 POLB 349/4885ABL1 198/4885RIN1 3565/4885
US-20110269707-A1 Modified nucleosides for the treatment of viral infections and abnormal cellullar proliferation PNP, ALPP, XDH POLB 425/4885ABL1 907/4885RIN1 4539/4885
US-10100076-B2 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation SLC29A1, SLC29A2, PNP POLB 282/4885ABL1 322/4885RIN1 3994/4885
US-20030087873-A1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation SLC29A1, PNP, SLC29A2 POLB 421/4885ABL1 256/4885RIN1 3597/4885

“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.