SCHEMBL3286808

SCHEMBL3286808

C[C@@]1(O)[C@H](OCc2ccc(Cl)cc2Cl)[C@@H](COCc2ccc(Cl)cc2Cl)O[C@H]1n1cc(I)c2c(N)ncnc21

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 13/20 0.42
▸ PRMT5 O14744 2/20 0.37
▸ WDR77 Q9BQA1 1/20 0.37
▸ ADORA2A P29274 2/20 0.36
▸ HASPIN Q8TF76 1/20 0.35
▸ RET P07949 1/20 0.34
▸ METTL3 Q86U44 2/20 0.34

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
SCHEMBL5525543 0.92 ADK (0.43) ADKPRMT5WDR77ADORA2A
SCHEMBL3285722 0.92 ADK (0.43) ADKPRMT5WDR77ADORA2A
SCHEMBL5450578 0.89 PRMT5 (0.41) ADKPRMT5WDR77ADORA2AHASPIN
SCHEMBL5524329 0.88 PRMT5 (0.35) ADKPRMT5WDR77ADORA2ARET
SCHEMBL5317477 0.88 PRMT5 (0.35) ADKPRMT5WDR77ADORA2ARET
SCHEMBL5526510 0.86 RNMT (0.40) ADKPRMT5WDR77ADORA2ARET
SCHEMBL5520919 0.86 RET (0.34) ADKPRMT5WDR77ADORA2ARET
SCHEMBL3285867 0.85 ADORA2A (0.33) ADKADORA2A
SCHEMBL1738357 0.85 ADK (0.38) ADKPRMT5WDR77ADORA2A
SCHEMBL3286448 0.85 RET (0.36) PRMT5WDR77ADORA2ARETMETTL3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100311684-A1 NOVEL TRICYCLIC NUCLEOSIDES OR NUCLEOTIDES AS THERAPEUTIC AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2010-12-09 — — US disclosed
EP-1660511-B1 NOVEL TRICYCLIC NUCLEOSIDES OR NUCLEOTIDES AS THERAPEUTIC AGENTS BIOTA SCIENT MANAGEMENT (AU) 2010-11-03 — — EP disclosed
US-7713941-B2 Tricyclic nucleosides or nucleotides as therapeutic agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2010-05-11 — — US disclosed
US-20080200423-A1 Novel Tricyclic Nucleosides or Nucleotides as Therapeutic Agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2008-08-21 — — US disclosed
US-7268119-B2 Tricyclic nucleosides or nucleotides as therapeutic agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2007-09-11 — — US disclosed
WO-2007084157-A2 NUCLEOSIDE PRODRUGS FOR TREATING VIRAL INFECTIONS GENELABS TECHNOLOGIES, INC. (US) 2007-07-26 — — WO disclosed
US-20070135363-A1 NOVEL TRICYCLIC NUCLEOSIDES OR NUCLEOTIDES AS THERAPEUTIC AGENTS BIOTA, INC. (US) 2007-06-14 — — US disclosed
US-7157434-B2 Nucleoside compounds for treating viral infections GENELABS TECHNOLOGIES, INC. (US) 2007-01-02 — — US disclosed
EP-1682564-A1 METHODS FOR PREPARING 7-(2 -SUBSTITUTED-s-D-RIBOFURANO SYL)-4-(NR2R3)-5-(SUBSTITUTED ETHYN-1-YL)-PYRROLO 2,3-D|PYRIMIDINE DERIVATIVES GENELABS TECHNOLOGIES, INC. (US) 2006-07-26 — — EP disclosed
WO-2005044835-A1 METHODS FOR PREPARING 7-(2'-SUBSTITUTED-ß-D-RIBOFURANOSYL)-4-(NR2R3)-5-(SUBSTITUTED ETHYN-1-YL)-PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES GENELABS TECHNOLOGIES, INC. (US) 2005-05-19 — — 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 (3 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-20070135363-A1 NOVEL TRICYCLIC NUCLEOSIDES OR NUCLEOTIDES AS THERAPEUTIC AGENTS NTPCR, NME1, NME2 ADK 119/4885PRMT5 3776/4885WDR77 907/4885
US-20080200423-A1 Novel Tricyclic Nucleosides or Nucleotides as Therapeutic Agents NME1, NME2, NTPCR ADK 203/4885PRMT5 3874/4885WDR77 1130/4885
US-20100311684-A1 NOVEL TRICYCLIC NUCLEOSIDES OR NUCLEOTIDES AS THERAPEUTIC AGENTS NTPCR, NME1, NME2 ADK 119/4885PRMT5 3776/4885WDR77 907/4885

“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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