SCHEMBL2611636

SCHEMBL2611636

C=CCOC1CC(n2cc(I)c(N)nc2=O)OC1CC

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALB P02768 1/20 0.34
▸ DNMT1 P26358 5/20 0.33
▸ ADRB1 P08588 1/20 0.33
▸ POLG P54098 1/20 0.32
▸ DNMT3B Q9UBC3 1/20 0.32
▸ ADK P55263 1/20 0.31
▸ TK1 P04183 1/20 0.31

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
SCHEMBL429523 0.90 DNMT1 (0.42) ALBDNMT1ADRB1DNMT3BTK1
SCHEMBL429524 0.90 DNMT1 (0.42) ALBDNMT1ADRB1DNMT3BTK1
SCHEMBL2611637 0.90 DNMT1 (0.42) ALBDNMT1ADRB1DNMT3BTK1
SCHEMBL887459 0.90 DNMT1 (0.42) ALBDNMT1ADRB1DNMT3BTK1
SCHEMBL430399 0.86 TOP2A (0.36) DNMT1ADRB1
SCHEMBL10080771 0.86 TOP2A (0.36) DNMT1ADRB1
SCHEMBL430398 0.86 TOP2A (0.36) DNMT1ADRB1
SCHEMBL887464 0.86 TOP2A (0.36) DNMT1ADRB1
SCHEMBL2611639 0.83 ALB (0.32) ALBDNMT1ADRB1
SCHEMBL19107437 0.82 ALB (0.34) ALBDNMT1ADRB1POLGDNMT3B

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-20160362737-A1 MODIFIED NUCLEOTIDES SOLEXA LIMITED (GB) 2016-12-15 — — US disclosed
US-9388464-B2 Modified nucleotides ILLUMINA CAMBRIDGE LIMITED (GB) 2016-07-12 — — US disclosed
US-20160032378-A1 MODIFIED NUCLEOTIDES SOLEXA LIMITED (GB) 2016-02-04 — — US disclosed
US-9121060-B2 Modified nucleotides ILLUMINA CAMBRIDGE LIMITED (GB) 2015-09-01 — — US disclosed
US-20130197209-A1 MODIFIED NUCLEOTIDES ILLUMINA CAMBRIDGE LIMITED (GB) 2013-08-01 — — US disclosed
US-20120095201-A1 MODIFIED NUCLEOTIDES ILLUMINA CAMBRIDGE LIMITED (GB) 2012-04-19 — — 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 (3 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-20160362737-A1 MODIFIED NUCLEOTIDES ADAR, NT5C2, NSUN2 ALB 4766/4885DNMT1 235/4885ADRB1 2081/4885
US-20130197209-A1 MODIFIED NUCLEOTIDES ADAR, NT5C2, NSUN2 ALB 4765/4885DNMT1 241/4885ADRB1 2083/4885
US-20120095201-A1 MODIFIED NUCLEOTIDES RNMT, NSUN2, NSUN3 ALB 3428/4885DNMT1 173/4885ADRB1 2971/4885

“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.

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