SCHEMBL14769878

SCHEMBL14769878

CC(C)(C)C(=O)OCOP(=O)(NCc1ccccc1)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)[C@](C)(O)[C@@H]1O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HINT1 P49773 2/20 0.49
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44
NT5E P21589 2/20 0.41
KRAS P01116 3/20 0.41
ADORA3 P0DMS8 1/20 0.41
TGM2 P21980 1/20 0.41
FUT6 P51993 1/20 0.41
POLB P06746 1/20 0.40
GSK3A P49840 1/20 0.40
RPS6KA3 P51812 1/20 0.40
MAPK14 Q16539 1/20 0.40

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
SCHEMBL18636126 0.94 HINT1 (0.50) HINT1TAS1R3TAS1R1NT5EKRAS
SCHEMBL17955416 0.93 ADORA3 (0.41) HINT1TAS1R3TAS1R1NT5EADORA3
SCHEMBL17232119 0.88 HINT1 (0.49) HINT1TAS1R3TAS1R1NT5EKRAS
SCHEMBL18636353 0.87 NT5E (0.41) HINT1TAS1R3TAS1R1NT5EKRAS
SCHEMBL12202712 0.86 HINT1 (0.45) HINT1TAS1R3TAS1R1NT5EKRAS
SCHEMBL12758246 0.86 HINT1 (0.45) HINT1TAS1R3TAS1R1NT5EKRAS
SCHEMBL3132403 0.86 HINT1 (0.45) HINT1TAS1R3TAS1R1NT5EKRAS
SCHEMBL10819846 0.86 HINT1 (0.45) HINT1TAS1R3TAS1R1NT5EKRAS
SCHEMBL13522420 0.86 HINT1 (0.45) HINT1TAS1R3TAS1R1NT5EKRAS
SCHEMBL16350180 0.86 HINT1 (0.45) HINT1TAS1R3TAS1R1NT5EKRAS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2755983-B1 SUBSTITUTED CARBONYLOXYMETHYLPHOSPHORAMIDATE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF VIRAL INFECTIONS IDENIX PHARMACEUTICALS LLC (US) 2017-03-15 EP disclosed
US-9403863-B2 Substituted carbonyloxymethylphosphoramidate compounds and pharmaceutical compositions for the treatment of viral infections IDENIX PHARMACEUTICALS LLC (US) 2016-08-02 US disclosed
US-9403863-B2 Substituted carbonyloxymethylphosphoramidate compounds and pharmaceutical compositions for the treatment of viral infections IDENIX PHARMACEUTICALS LLC (US) 2016-08-02 US disclosed
US-20130064794-A1 Substituted Carbonyloxymethylphosphoramidate Compounds and Pharmaceutical Compositions for the Treatment of Viral Infections IDENIX PHARMACEUTICALS, INC. (US) 2013-03-14 US disclosed
US-20130064794-A1 Substituted Carbonyloxymethylphosphoramidate Compounds and Pharmaceutical Compositions for the Treatment of Viral Infections IDENIX PHARMACEUTICALS, INC. (US) 2013-03-14 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-20130064794-A1 Substituted Carbonyloxymethylphosphoramidate Compounds and Pharmaceutical Compositions for the Treatment of Viral Infections PYGL, HAVCR2, PNP HINT1 1267/4885TAS1R3 4769/4885TAS1R1 4845/4885

“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.