SCHEMBL16777548

SCHEMBL16777548

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

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLA1 P09884 1/20 0.53
▸ P2RY1 P47900 5/20 0.48
▸ P2RX3 P56373 4/20 0.48
▸ P2RX1 P51575 3/20 0.48
▸ ENPP1 P22413 2/20 0.48
▸ P2RX4 Q99571 2/20 0.48
▸ P2RY11 Q96G91 2/20 0.48
▸ P2RY6 Q15077 1/20 0.48
▸ P2RY12 Q9H244 2/20 0.47
▸ RNASEL Q05823 4/20 0.46
▸ P2RX2 Q9UBL9 1/20 0.45
▸ GPR17 Q13304 3/20 0.43
▸ NT5E P21589 1/20 0.42

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
SCHEMBL16777344 1.00 POLA1 (0.53) POLA1P2RY1P2RX3P2RX1ENPP1
SCHEMBL16777519 0.92 P2RY1 (0.49) P2RY1P2RX3P2RX1ENPP1P2RX4
SCHEMBL17617926 0.91 P2RY1 (0.49) P2RY1P2RX3P2RX1ENPP1P2RX4
SCHEMBL16776967 0.90 POLA1 (0.56) POLA1P2RY1P2RX3P2RX1ENPP1
SCHEMBL16777770 0.90 POLA1 (0.56) POLA1P2RY1P2RX3P2RX1ENPP1
SCHEMBL16777534 0.90 POLA1 (0.56) POLA1P2RY1P2RX3P2RX1ENPP1
SCHEMBL16777864 0.90 POLA1 (0.56) POLA1P2RY1P2RX3P2RX1ENPP1
SCHEMBL26025267 0.89 POLA1 (0.55) POLA1P2RY1P2RX3P2RX1ENPP1
SCHEMBL16081063 0.89 P2RY1 (0.51) P2RY1P2RX3P2RX1ENPP1P2RX4
SCHEMBL26025244 0.88 GPR17 (0.53) POLA1P2RY1P2RX3P2RX1ENPP1

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 POLA1 276/4885P2RY1 1177/4885P2RX3 1278/4885

“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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