SCHEMBL13672352

SCHEMBL13672352

CC(C)[Si]1(C(C)C)OC[C@H]2O[C@@H](n3ccc(NC(=O)c4ccccc4)nc3=O)[C@@H](O)C2O[Si](C(C)C)(C(C)C)O1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ P2RY6 Q15077 9/20 0.47
▸ P2RY14 Q15391 2/20 0.47
▸ NT5E P21589 1/20 0.47
▸ ABL1 P00519 1/20 0.47
▸ RIN1 Q13671 1/20 0.47
▸ POLB P06746 1/20 0.45
▸ ST6GAL1 P15907 1/20 0.34
▸ P2RY2 P41231 6/20 0.34
▸ P2RY4 P51582 6/20 0.34
▸ P2RY12 Q9H244 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32

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
SCHEMBL13151571 1.00 P2RY6 (0.47) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL6365808 1.00 P2RY6 (0.47) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL5531861 0.90 P2RY6 (0.40) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL6932273 0.90 POLB (0.44) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL12404747 0.90 POLB (0.49) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL20215740 0.89 P2RY6 (0.34) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL20459987 0.89 P2RY6 (0.34) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL19981007 0.89 P2RY6 (0.34) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL1937265 0.89 P2RY6 (0.34) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL14946367 0.89 P2RY6 (0.34) P2RY6P2RY14NT5EABL1RIN1

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-20160024061-A1 PREPARATION OF 2'-FLUORO-2'-ALKYL-SUBSTITUTED OR OTHER OPTIONALLY SUBSTITUTED RIBOFURANOSYL PYRIMIDINES AND PURINES AND THEIR DERIVATIVES PHARMASSET, INC. 2016-01-28 — — US disclosed
US-8492539-B2 Preparation of 2′-fluoro-2′-alkyl-substituted or other optionally substituted ribofuranosyl pyrimidines and purines and their derivatives GILEAD PHARMASSET LLC (US) 2013-07-23 — — US disclosed
US-8481713-B2 Preparation of alkyl-substituted 2-deoxy-2-fluoro-D-ribofuranosyl pyrimidines and purines and their derivatives GILEAD PHARMASSET LLC (US) 2013-07-09 — — US disclosed
US-7601820-B2 Preparation of alkyl-substituted 2-deoxy-2-fluoro-D-ribofuranosyl pyrimidines and purines and their derivatives PHARMASSET, INC. (US) 2009-10-13 — — 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-20160024061-A1 PREPARATION OF 2'-FLUORO-2'-ALKYL-SUBSTITUTED OR OTHER OPTIONALLY SUBSTITUTED RIBOFURANOSYL PYRIMIDINES AND PURINES AND THEIR DERIVATIVES NSUN2, FBL, RNGTT P2RY6 543/4885P2RY14 696/4885NT5E 331/4885

“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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