SCHEMBL17198480

SCHEMBL17198480

CCOc1nc(N)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](CF)[C@H]1O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 5/20 0.56
▸ ADORA2B P29275 4/20 0.56
▸ ADORA3 P0DMS8 2/20 0.56
▸ ADORA1 P30542 2/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ SLC29A1 Q99808 5/20 0.55
▸ PGK1 P00558 1/20 0.51
▸ PGK2 P07205 1/20 0.51
▸ LMNA P02545 1/20 0.50
▸ NT5E P21589 1/20 0.50
▸ HIF1A Q16665 1/20 0.50

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
SCHEMBL17198497 0.93 ADORA2A (0.59) ADORA2AADORA2BADORA3ADORA1CYP2C19
SCHEMBL2218888 0.89 ADORA2A (0.70) ADORA2AADORA2BADORA3ADORA1CYP2C19
SCHEMBL8970895 0.86 ADORA2A (0.62) ADORA2AADORA2BADORA3ADORA1CYP2C19
SCHEMBL8970907 0.86 ADORA2A (0.62) ADORA2AADORA2BADORA3ADORA1CYP2C19
SCHEMBL17198478 0.85 ALDH1A1 (0.47) ADORA2AADORA2BADORA3ADORA1CYP2C19
SCHEMBL16081039 0.85 ADORA2A (0.59) ADORA2AADORA2BADORA3ADORA1CYP2C19
SCHEMBL19186882 0.85 ADORA2A (0.59) ADORA2AADORA2BADORA3ADORA1CYP2C19
SCHEMBL13468488 0.85 ADORA2A (0.59) ADORA2AADORA2BADORA3ADORA1CYP2C19
SCHEMBL17198491 0.84 LMNA (0.61) ADORA2AADORA2BADORA3ADORA1CYP2C19
SCHEMBL16081038 0.82 ADORA2A (0.56) ADORA2AADORA2BADORA3ADORA1CYP2C19

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-3131914-B1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS LLC (US) 2023-05-10 — — EP disclosed
US-10202411-B2 3′-substituted methyl or alkynyl nucleosides nucleotides for the treatment of HCV IDENIX PHARMACEUTICALS LLC (US) 2019-02-12 — — US disclosed
US-20170044205-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES NUCLEOTIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. 2017-02-16 — — US disclosed
US-20170044205-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES NUCLEOTIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. 2017-02-16 — — US disclosed
WO-2015161137-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. (US) 2015-10-22 — — 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 (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-20170044205-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES NUCLEOTIDES FOR THE TREATMENT OF HCV RB1, NSUN2, METTL3 ADORA2A 122/4885ADORA2B 195/4885ADORA3 139/4885
US-10202411-B2 3′-substituted methyl or alkynyl nucleosides nucleotides for the treatment of HCV RB1, NSUN2, METTL3 ADORA2A 111/4885ADORA2B 188/4885ADORA3 140/4885

“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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