SCHEMBL6306348

SCHEMBL6306348

Nc1nc(F)cc2c1ncn2[C@H]1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 8/20 0.61
▸ HTR1A P08908 1/20 0.54
▸ BCHE P06276 1/20 0.48
▸ ADORA2A P29274 1/20 0.42
▸ ADORA2B P29275 1/20 0.42
▸ HSPA5 P11021 1/20 0.40
▸ TP53 P04637 2/20 0.40
▸ MDM2 Q00987 2/20 0.40
▸ AHCY P23526 1/20 0.39
▸ PTPN2 P17706 1/20 0.38
▸ PTPN1 P18031 1/20 0.38
▸ PTPN11 Q06124 1/20 0.38
▸ MDM4 O15151 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.38
▸ HSP90AB1 P08238 1/20 0.38
▸ NT5E P21589 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
SCHEMBL6306351 1.00 PDE2A (0.61) PDE2AHTR1ABCHEADORA2AADORA2B
SCHEMBL11121799 0.92 PDE2A (0.59) PDE2AHTR1ABCHEADORA2AADORA2B
SCHEMBL750344 0.86 PDE2A (0.72) PDE2AHTR1ABCHEADORA2AADORA2B
SCHEMBL11126005 0.86 PDE2A (0.56) PDE2AHTR1ABCHEADORA2AADORA2B
SCHEMBL8764444 0.83 PDE2A (0.70) PDE2AHTR1ABCHEADORA2AADORA2B
SCHEMBL11123492 0.82 HTR1A (0.55) PDE2AHTR1ABCHETP53MDM2
SCHEMBL11123141 0.82 HTR1A (0.59) PDE2AHTR1ABCHEPTPN2PTPN1
SCHEMBL11420439 0.80 PDE2A (0.61) PDE2AHTR1ABCHEADORA2AADORA2B
SCHEMBL11427985 0.80 PDE2A (0.64) PDE2AHTR1ABCHEADORA2AADORA2B
SCHEMBL5961364 0.80 PDE2A (0.64) PDE2AHTR1ABCHEADORA2AADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6960568-B2 Nucleosides and related processes, pharmaceutical compositions and methods YALE UNIVERSITY (US) 2005-11-01 — — US disclosed
US-20050239726-A1 Novel nucleosides and related processes, pharmaceutical compositions and methods YALE UNIVERSITY (US) 2005-10-27 — — US disclosed
US-20040116362-A1 Novel nucleosides and related processes, pharmaceutical compositions and methods YALE UNIVERSITY 2004-06-17 — — 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-20050239726-A1 Novel nucleosides and related processes, pharmaceutical compositions and methods ADAR, DCTD, ADA PDE2A 329/4885HTR1A 1247/4885BCHE 2292/4885

“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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