SCHEMBL455645

SCHEMBL455645

O=C(O)Cn1cnc2c(=O)[nH]cnc21

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 13/20 0.62
KDM4E B2RXH2 1/20 0.55
ALDH1A1 P00352 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
PNP P00491 2/20 0.54
MEN1 O00255 1/20 0.50
LMNA P02545 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL7374581 0.85 HPRT1 (0.64) HPRT1PNP
SCHEMBL11258920 0.79 HPRT1 (0.69) HPRT1PNP
SCHEMBL7398699 0.79 HPRT1 (0.54) HPRT1PNP
SCHEMBL24239249 0.79 HPRT1 (0.63) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL1993930 0.79 HPRT1 (0.63) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL7569894 0.78 HPRT1 (0.58) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL3060815 0.78 HPRT1 (0.63) HPRT1PNP
SCHEMBL455494 0.78 PNP (0.64) HPRT1ALDH1A1PNPMEN1LMNA
SCHEMBL20782416 0.76 HPRT1 (0.65) HPRT1PNP
SCHEMBL2979895 0.76 MEN1 (0.68) HPRT1PNPMEN1LMNAKMT2A

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-20210238595-A1 MODIFIED RNA AGENTS WITH REDUCED OFF-TARGET EFFECT ALNYLAM PHARMACEUTICALS, INC. (US) 2021-08-05 US disclosed
US-8859490-B2 Peptide nucleic acid monomers and oligomers NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2014-10-14 US disclosed
US-20120065364-A2 PEPTIDE NUCLEIC ACID MONOMERS AND OLIGOMERS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2012-03-15 US disclosed
US-20110245458-A1 PEPTIDE NUCLEIC ACID MONOMERS AND OLIGOMERS NANYANG TECHONOLOGICAL UNIVERSITY (SG) 2011-10-06 US disclosed
WO-2010027326-A1 PEPTIDE NUCLEIC ACID MONOMERS AND OLIGOMERS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2010-03-11 WO 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 (2 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-20120065364-A2 PEPTIDE NUCLEIC ACID MONOMERS AND OLIGOMERS SIN3A, POLR2H, CYTH3 HPRT1 3808/4885KDM4E 4577/4885ALDH1A1 4860/4885
US-20110245458-A1 PEPTIDE NUCLEIC ACID MONOMERS AND OLIGOMERS SIN3A, POLR2H, CYTH3 HPRT1 3808/4885KDM4E 4577/4885ALDH1A1 4860/4885

“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.