SCHEMBL9911234

SCHEMBL9911234

CC1(C)OCC([C@H]2OC3OC(C)(C)O[C@@H]3[C@@H]2OS(=O)(=O)C(F)(F)F)O1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 9/20 0.72
▸ CA1 P00915 7/20 0.72
▸ CA9 Q16790 4/20 0.72
▸ CA12 O43570 2/20 0.35
▸ CA4 P22748 2/20 0.35
▸ CA5A P35218 2/20 0.35
▸ CA7 P43166 2/20 0.35
▸ CA14 Q9ULX7 2/20 0.35
▸ CA5B Q9Y2D0 2/20 0.35
▸ CA6 P23280 1/20 0.35
▸ CA13 Q8N1Q1 1/20 0.35

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
SCHEMBL9911368 1.00 CA2 (0.72) CA2CA1CA9CA12CA4
SCHEMBL14414834 1.00 CA2 (0.72) CA2CA1CA9CA12CA4
SCHEMBL1370811 1.00 CA2 (0.72) CA2CA1CA9CA12CA4
SCHEMBL8248779 1.00 CA2 (0.72) CA2CA1CA9CA12CA4
SCHEMBL23902622 1.00 CA2 (0.72) CA2CA1CA9CA12CA4
SCHEMBL1170798 1.00 CA2 (0.72) CA2CA1CA9CA12CA4
SCHEMBL23902613 1.00 CA2 (0.72) CA2CA1CA9CA12CA4
SCHEMBL14419747 1.00 CA2 (0.72) CA2CA1CA9CA12CA4
SCHEMBL5665101 0.86 CA2 (0.81) CA2CA1CA9CA12CA4
SCHEMBL2757717 0.86 CA2 (0.81) CA2CA1CA9CA12CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8193342-B2 Method for preparing furanose compounds ANADYS PHARMACEUTICALS, INC. (US) 2012-06-05 — — US disclosed
US-20110172447-A1 METHOD FOR PREPARING FURANOSE COMPOUNDS ANADYS PHARMACEUTICALS, INC. (US) 2011-07-14 — — US disclosed
US-7928085-B2 P-toluene sulfonic acid salt of 5-amino-3-(2′-O-acetyl-3′-deoxy-β-D-ribofuranosyl)-3H-thiazole[4,5-d]pyrimidine-2-one and methods for preparation ANADYS PHARMACEUTICALS, INC. (US) 2011-04-19 — — US disclosed
US-7928085-B2 P-toluene sulfonic acid salt of 5-amino-3-(2′-O-acetyl-3′-deoxy-β-D-ribofuranosyl)-3H-thiazole[4,5-d]pyrimidine-2-one and methods for preparation ANADYS PHARMACEUTICALS, INC. (US) 2011-04-19 — — US disclosed
US-20090197826-A1 P-Toluene Sulfonic Acid Salt of 5-Amino-3-(2'-O-Acetyl-3'-Deoxy-Beta-D-Ribofuranosyl)-3H-Thiazole[4,5-d]pyrimidine-2-one and Methods for Preparation ANADYS PHARMACEUTICALS, INC. (US) 2009-08-06 — — US disclosed
US-20090197826-A1 P-Toluene Sulfonic Acid Salt of 5-Amino-3-(2'-O-Acetyl-3'-Deoxy-Beta-D-Ribofuranosyl)-3H-Thiazole[4,5-d]pyrimidine-2-one and Methods for Preparation ANADYS PHARMACEUTICALS, INC. (US) 2009-08-06 — — 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 (2 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-20090197826-A1 P-Toluene Sulfonic Acid Salt of 5-Amino-3-(2'-O-Acetyl-3'-Deoxy-Beta-D-Ribofuranosyl)-3H-Thiazole[4,5-d]pyrimidine-2-one and Methods for Preparation DPYD, APRT, TYMS CA2 1924/4885CA1 2394/4885CA9 1880/4885
US-20110172447-A1 METHOD FOR PREPARING FURANOSE COMPOUNDS DPYD, TYMS, TST CA2 2156/4885CA1 1877/4885CA9 1484/4885

“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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