SCHEMBL2587542

SCHEMBL2587542

O=c1nc(NO)c(-c2ccccc2)cn1[C@H]1C[C@H](O)[C@@H](CO)O1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADK P55263 1/20 0.55
DNMT1 P26358 3/20 0.51
ADRB1 P08588 1/20 0.51
TYMS P04818 1/20 0.47

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
SCHEMBL5983046 0.85 DNMT1 (0.58) ADKDNMT1ADRB1TYMS
SCHEMBL5983051 0.85 DNMT1 (0.58) ADKDNMT1ADRB1TYMS
SCHEMBL2589487 0.85 DNMT1 (0.49) ADKDNMT1ADRB1
SCHEMBL2584723 0.82 DNMT1 (0.55) DNMT1ADRB1
SCHEMBL2584344 0.82 DNMT1 (0.55) DNMT1ADRB1
SCHEMBL2585638 0.82 DNMT1 (0.55) DNMT1ADRB1
SCHEMBL4276793 0.82 LMNA (0.58) DNMT1ADRB1
SCHEMBL2587803 0.82 TK1 (0.58) DNMT1ADRB1
SCHEMBL2588008 0.82 LMNA (0.58) DNMT1ADRB1
SCHEMBL4291160 0.82 DNMT1 (0.55) DNMT1ADRB1

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 5 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-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 ADK 1008/4885DNMT1 2568/4885ADRB1 744/4885
US-20110269707-A1 Modified nucleosides for the treatment of viral infections and abnormal cellullar proliferation PNP, ALPP, XDH ADK 876/4885DNMT1 2658/4885ADRB1 1219/4885
US-10100076-B2 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation SLC29A1, SLC29A2, PNP ADK 1033/4885DNMT1 3151/4885ADRB1 349/4885
US-20030087873-A1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation SLC29A1, PNP, SLC29A2 ADK 1127/4885DNMT1 2832/4885ADRB1 848/4885

“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.