SCHEMBL6061616

SCHEMBL6061616

Nc1nc2c(c(I)c(Cl)n2[C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 2/20 0.44
▸ TK1 P04183 2/20 0.44
▸ ADRB1 P08588 1/20 0.42
▸ DNMT1 P26358 1/20 0.42
▸ LMNA P02545 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ TP53 P04637 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ PDE4D Q08499 1/20 0.41
▸ PDE3A Q14432 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ CYP3A4 P08684 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ PMP22 Q01453 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ MEN1 O00255 1/20 0.38

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
SCHEMBL6061619 1.00 PNP (0.44) PNPTK1ADRB1DNMT1LMNA
SCHEMBL6061835 0.90 PNP (0.43) PNPTK1ADRB1DNMT1LMNA
SCHEMBL6061839 0.90 PNP (0.43) PNPTK1ADRB1DNMT1LMNA
SCHEMBL6061557 0.88 TK1 (0.44) PNPTK1ADRB1DNMT1LMNA
SCHEMBL6061560 0.88 PNP (0.42) PNPTK1ADRB1DNMT1LMNA
SCHEMBL6061556 0.88 TK1 (0.44) PNPTK1ADRB1DNMT1LMNA
SCHEMBL6061562 0.88 PNP (0.42) PNPTK1ADRB1DNMT1LMNA
SCHEMBL6061911 0.81 PNP (0.43) PNPTK1ADRB1DNMT1LMNA
SCHEMBL6061917 0.81 PNP (0.43) PNPTK1ADRB1DNMT1LMNA
SCHEMBL13337883 0.81 TK1 (0.47) PNPTK1ADRB1DNMT1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6987177-B2 Modified oligonucleotides, their preparation and their use AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2006-01-17 — — US disclosed
US-20030096981-A1 Modified oligonucleotides, their preparation and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2003-05-22 — — US disclosed
US-6479651-B1 Modified oligonucleotides, their preparation and their use AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-11-12 — — US disclosed
US-6150510-A NUCLEOTIDES/NUCLEOSIDES WITH SUBSTITUTED 7-DEAZAPURINE BASE FORM MORE STABLE HYBRIDIZATION COMPLEXES; GENETIC PROBES; ANTISENSE AGENTS; GENE EXPRESSION INHIBITION; DIAGNOSTIC AGENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-11-21 — — 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-20030096981-A1 Modified oligonucleotides, their preparation and their use NSUN2, TYMP, ADAR PNP 21/4885TK1 78/4885ADRB1 4244/4885

“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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