SCHEMBL13685832

SCHEMBL13685832

[N-]=[N+]=NCCc1c[nH]c(=O)[nH]c1=O

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DPYD Q12882 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ ATAD2 Q6PL18 1/20 0.37

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
SCHEMBL30850435 0.84 DPYD (0.38) DPYDGAAATAD2
SCHEMBL4353311 0.79 DPYD (0.50) DPYDGAAATAD2
SCHEMBL7074433 0.72 LMNA (0.43) DPYDGAAATAD2
SCHEMBL2320491 0.72 ALDH1A1 (0.48) DPYDGAAATAD2
SCHEMBL156784 0.72 ATAD2 (0.48) ATAD2
SCHEMBL5800398 0.71 — —
SCHEMBL31236144 0.70 DPYD (0.45) DPYDGAAATAD2
SCHEMBL7599681 0.69 ALDH1A1 (0.45) DPYDGAAATAD2
SCHEMBL18640315 0.69 — —
SCHEMBL161148 0.69 ATAD2 (0.54) DPYDGAAATAD2

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-7777024-B2 Process for preparing a pentopyranosyl nucleic acid conjugate AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. (DE) 2010-08-17 — — US disclosed
US-7777024-B2 Process for preparing a pentopyranosyl nucleic acid conjugate AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. (DE) 2010-08-17 — — US disclosed
US-20090221793-A1 PROCESS FOR PREPARING A PENTOPYRANOSYL NUCLEIC ACID CONJUGATE SANOFI-AVENTIS S.A. (FR) 2009-09-03 — — US disclosed
US-20090221793-A1 PROCESS FOR PREPARING A PENTOPYRANOSYL NUCLEIC ACID CONJUGATE SANOFI-AVENTIS S.A. (FR) 2009-09-03 — — US disclosed
US-7501506-B2 Pentopyranosyl nucleic acid conjugates NANOGEN RECOGNOMICS GMBH (DE) 2009-03-10 — — US disclosed
US-7501506-B2 Pentopyranosyl nucleic acid conjugates NANOGEN RECOGNOMICS GMBH (DE) 2009-03-10 — — 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 (1 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-20090221793-A1 PROCESS FOR PREPARING A PENTOPYRANOSYL NUCLEIC ACID CONJUGATE RNGTT, NT5C3B, FUT6 DPYD 66/4885GAA 344/4885ATAD2 4173/4885

“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.

Send feedback