SCHEMBL16777519

SCHEMBL16777519

CCOc1nc(N)nc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)C1(Cl)Cl

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 6/20 0.49
▸ P2RX3 P56373 5/20 0.49
▸ P2RX1 P51575 3/20 0.49
▸ ENPP1 P22413 2/20 0.49
▸ P2RX4 Q99571 2/20 0.49
▸ P2RY6 Q15077 1/20 0.49
▸ P2RY11 Q96G91 1/20 0.49
▸ P2RY12 Q9H244 2/20 0.48
▸ RNASEL Q05823 3/20 0.47
▸ P2RX2 Q9UBL9 2/20 0.46
▸ GPR17 Q13304 3/20 0.44
▸ NT5E P21589 1/20 0.44

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
SCHEMBL17617926 0.93 P2RY1 (0.49) P2RY1P2RX3P2RX1ENPP1P2RX4
SCHEMBL16777548 0.92 POLA1 (0.53) P2RY1P2RX3P2RX1ENPP1P2RX4
SCHEMBL16777344 0.92 POLA1 (0.53) P2RY1P2RX3P2RX1ENPP1P2RX4
SCHEMBL16081063 0.90 P2RY1 (0.51) P2RY1P2RX3P2RX1ENPP1P2RX4
SCHEMBL16777578 0.90 P2RY1 (0.56) P2RY1P2RX3P2RX1ENPP1P2RX4
SCHEMBL16776968 0.90 NT5E (0.54) P2RY1P2RX3P2RX1ENPP1P2RX4
SCHEMBL16081073 0.88 P2RX3 (0.48) P2RY1P2RX3P2RX1ENPP1P2RX4
SCHEMBL16081124 0.86 P2RY1 (0.46) P2RY1P2RX3P2RX1ENPP1P2RX4
SCHEMBL31029199 0.85 P2RY1 (0.68) P2RY1P2RX3P2RX1ENPP1P2RX4
SCHEMBL17615357 0.84 RNASEL (0.50) P2RY1P2RX3P2RX1ENPP1P2RX4

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-20170198005-A1 2'-DICHLORO AND 2'-FLUORO-2'-CHLORO NUCLEOSIDE ANALOGUES FOR HCV INFECTION IDENIX PHARMACEUTICALS LLC (US) 2017-07-13 — — US disclosed
US-20170198005-A1 2'-DICHLORO AND 2'-FLUORO-2'-CHLORO NUCLEOSIDE ANALOGUES FOR HCV INFECTION IDENIX PHARMACEUTICALS LLC (US) 2017-07-13 — — US disclosed
WO-2015081297-A1 2'-DICHLORO AND 2'-FLUORO-2'-CHLORO NUCLEOSIDE ANALOGUES FOR HCV INFECTION IDENIX PHARMACEUTICALS, INC. (US) 2015-06-04 — — 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 (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-20170198005-A1 2'-DICHLORO AND 2'-FLUORO-2'-CHLORO NUCLEOSIDE ANALOGUES FOR HCV INFECTION HAVCR2, SLC29A2, SLC28A2 P2RY1 1177/4885P2RX3 1278/4885P2RX1 1262/4885

“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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