SCHEMBL4572452

SCHEMBL4572452

COC[C@](C)(COP(=O)(O)COCCn1cnc2c(=O)[nH]c(N)nc21)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.58
POLA1 P09884 1/20 0.57
POLG P54098 1/20 0.57
HPRT1 P00492 7/20 0.56
PNP P00491 9/20 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
SCHEMBL4570533 0.90 POLB (0.54) POLBPOLA1POLGHPRT1PNP
SCHEMBL16063241 0.88 POLB (0.71) POLBPOLA1POLGHPRT1PNP
SCHEMBL16063251 0.88 POLB (0.71) POLBPOLA1POLGHPRT1PNP
SCHEMBL16075000 0.88 POLB (0.71) POLBPOLA1POLGHPRT1PNP
SCHEMBL4572451 0.86 POLB (0.42) POLBPOLA1POLGHPRT1
SCHEMBL10072431 0.83 POLB (0.60) POLBPOLA1POLGHPRT1PNP
SCHEMBL17617678 0.83 POLB (0.60) POLBPOLA1POLGHPRT1PNP
SCHEMBL17617679 0.81 POLB (0.76) POLBPOLA1POLGHPRT1PNP
SCHEMBL17622636 0.81 POLB (0.70) POLBPOLA1POLGHPRT1PNP
SCHEMBL17617677 0.80 POLB (0.57) POLBPOLA1POLGHPRT1PNP

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8318700-B2 Lung-targeted drugs THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-11-27 US disclosed
US-20120122818-A1 LUNG-TARGETED DRUGS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-05-17 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-20120122818-A1 LUNG-TARGETED DRUGS DGKG, GK, PHOSPHO1 POLB 4155/4885POLA1 4456/4885POLG 2538/4885

“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.