SCHEMBL2585638

SCHEMBL2585638

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

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 3/20 0.55
ADRB1 P08588 1/20 0.55
PIM1 P11309 1/20 0.46
CSNK2A2 P19784 1/20 0.46
CSNK2B P67870 1/20 0.46
CSNK2A1 P68400 1/20 0.46
CSNK2A3 Q8NEV1 1/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TK1 P04183 1/20 0.46

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
SCHEMBL4276793 0.86 LMNA (0.58) DNMT1ADRB1LMNASMN1; SMN2TK1
SCHEMBL4291160 0.86 DNMT1 (0.55) DNMT1ADRB1LMNASMN1; SMN2TK1
SCHEMBL2584344 0.86 DNMT1 (0.55) DNMT1ADRB1LMNASMN1; SMN2TK1
SCHEMBL2587803 0.86 TK1 (0.58) DNMT1ADRB1LMNASMN1; SMN2TK1
SCHEMBL2588008 0.86 LMNA (0.58) DNMT1ADRB1LMNASMN1; SMN2TK1
SCHEMBL2584723 0.86 DNMT1 (0.55) DNMT1ADRB1LMNASMN1; SMN2TK1
SCHEMBL2582482 0.85 DNMT1 (0.54) DNMT1ADRB1TK1
SCHEMBL2579556 0.84 TK1 (0.61) DNMT1ADRB1LMNASMN1; SMN2TK1
SCHEMBL2579557 0.84 TK1 (0.61) DNMT1ADRB1LMNASMN1; SMN2TK1
SCHEMBL5982335 0.83 DNMT1 (0.63) DNMT1ADRB1PIM1CSNK2A2CSNK2B

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 DNMT1 2568/4885ADRB1 744/4885PIM1 2532/4885
US-20110269707-A1 Modified nucleosides for the treatment of viral infections and abnormal cellullar proliferation PNP, ALPP, XDH DNMT1 2658/4885ADRB1 1219/4885PIM1 3322/4885
US-10100076-B2 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation SLC29A1, SLC29A2, PNP DNMT1 3151/4885ADRB1 349/4885PIM1 2680/4885
US-20030087873-A1 Modified nucleosides for the treatment of viral infections and abnormal cellular proliferation SLC29A1, PNP, SLC29A2 DNMT1 2832/4885ADRB1 848/4885PIM1 2697/4885

“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.