SCHEMBL22158693

SCHEMBL22158693

[2H]C([2H])([2H])C([2H])([2H])OCc1nc2cnc3ccccc3c2n1CC(C)(C)O

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.52
TLR8 Q9NR97 8/20 0.52
NUDT1 P36639 1/20 0.52

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
SCHEMBL1706194 0.87 TLR7 (0.67) TLR7TLR8NUDT1
SCHEMBL5451703 0.85 TLR7 (0.56) TLR7TLR8NUDT1
SCHEMBL1890829 0.85 TLR7 (0.52) TLR7TLR8NUDT1
SCHEMBL22158729 0.84 TLR7 (0.58) TLR7TLR8NUDT1
Resiquimod SCHEMBL31355424 0.82 TLR7 (0.78) TLR7TLR8NUDT1
Resiquimod SCHEMBL22158717 0.82 TLR7 (0.78) TLR7TLR8NUDT1
SCHEMBL6719547 0.81 TLR7 (0.51) TLR7TLR8NUDT1
SCHEMBL1895853 0.81 TLR7 (0.53) TLR7TLR8NUDT1
SCHEMBL6726559 0.81 TLR7 (0.51) TLR7TLR8NUDT1
SCHEMBL22158688 0.80 TLR7 (0.47) TLR7TLR8NUDT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12077535-B2 Derivatives of resiquimod SUPERB WISDOM LIMITED (WS) 2024-09-03 US disclosed
US-20230002370-A1 DERIVATIVES OF RESIQUIMOD SUPERB WISDOM LIMITED (WS) 2023-01-05 US disclosed
US-11274099-B2 Derivatives of Resiquimod SUPERB WISDOM LIMITED (WS) 2022-03-15 US disclosed
US-20200207757-A1 DERIVATIVES OF RESIQUIMOD SUPERB WISDOM LIMITED (WS) 2020-07-02 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 (4 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-20200207757-A1 DERIVATIVES OF RESIQUIMOD MYD88, TLR7, HLA-DRB1 TLR7 2/4885TLR8 28/4885NUDT1 209/4885
US-20230002370-A1 DERIVATIVES OF RESIQUIMOD MYD88, TLR7, HLA-DRB1 TLR7 2/4885TLR8 28/4885NUDT1 209/4885
US-11274099-B2 Derivatives of Resiquimod MYD88, TLR7, HLA-DRB1 TLR7 2/4885TLR8 28/4885NUDT1 209/4885
US-12077535-B2 Derivatives of resiquimod MYD88, TLR7, HLA-DRB1 TLR7 2/4885TLR8 28/4885NUDT1 209/4885

“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.