SCHEMBL7644667

SCHEMBL7644667

N#Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c2nc([AsH2])[nH]c(=O)c12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 2/20 0.52
HIF1A Q16665 1/20 0.52
DOT1L Q8TEK3 3/20 0.48
ADK P55263 3/20 0.48
HPGD P15428 1/20 0.46
ALDH1A1 P00352 1/20 0.46
PYGM P11217 3/20 0.46
SLC29A1 Q99808 2/20 0.43
SLC28A1 O00337 1/20 0.43
SLC28A2 O43868 1/20 0.43
SLC28A3 Q9HAS3 1/20 0.43
TK2 O00142 2/20 0.43
PRMT5 O14744 1/20 0.43
PRMT3 O60678 1/20 0.43
DNMT1 P26358 1/20 0.43
EHMT2 Q96KQ7 1/20 0.43
LMNA P02545 1/20 0.42
THRB P10828 1/20 0.42
MTOR P42345 1/20 0.42
MDM2 Q00987 1/20 0.42

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
SCHEMBL1740288 0.89 PNP (0.54) PAX8HIF1ADOT1LADKHPGD
SCHEMBL12154731 0.89 PNP (0.54) PAX8HIF1ADOT1LADKHPGD
SCHEMBL6727042 0.89 PNP (0.54) PAX8HIF1ADOT1LADKHPGD
SCHEMBL16198949 0.89 PNP (0.54) PAX8HIF1ADOT1LADKHPGD
SCHEMBL1737182 0.89 PNP (0.54) PAX8HIF1ADOT1LADKHPGD
SCHEMBL12150656 0.89 PNP (0.54) PAX8HIF1ADOT1LADKHPGD
SCHEMBL6729944 0.89 PNP (0.54) PAX8HIF1ADOT1LADKHPGD
SCHEMBL31093987 0.82 PAX8 (0.55) PAX8HIF1ADOT1LADKALDH1A1
SCHEMBL1738360 0.78 ADK (0.51) PAX8HIF1ADOT1LADKALDH1A1
SCHEMBL1738396 0.78 ADK (0.51) PAX8HIF1ADOT1LADKALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020147160-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase MERCK SHARP & DOHME LLC 2002-10-10 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-20020147160-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase NSUN2, NSUN3, POLRMT PAX8 4785/4885HIF1A 3559/4885DOT1L 1622/4885

“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.