SCHEMBL25036705

SCHEMBL25036705

Nc1nc(N2CC3CC(C2)O3)n[nH]1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 9/20 0.54
▸ MAPT P10636 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.43
▸ GFER P55789 2/20 0.43
▸ CHIA Q9BZP6 8/20 0.39
▸ CHIT1 Q13231 7/20 0.39
▸ KCNH2 Q12809 4/20 0.36

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
SCHEMBL25037188 0.78 GAA (0.53) GAAMAPTALDH1A1GFERCHIA
SCHEMBL2455907 0.71 GAA (0.69) GAAMAPTALDH1A1GFERCHIA
SCHEMBL1994355 0.70 GAA (1.00) GAAMAPTALDH1A1GFERCHIA
SCHEMBL9793471 0.69 GAA (0.67) GAAMAPTALDH1A1GFERCHIA
SCHEMBL9793417 0.67 GAA (0.62) GAAMAPTALDH1A1GFERCHIA
SCHEMBL20476058 0.67 MTOR (0.38) —
SCHEMBL31214557 0.67 GAA (0.57) GAAMAPTALDH1A1GFERCHIA
SCHEMBL31214493 0.65 GAA (0.63) GAAMAPTALDH1A1GFERCHIA
SCHEMBL31387185 0.62 GAA (0.56) GAAMAPTALDH1A1GFERCHIA
SCHEMBL15400038 0.58 MAPT (0.45) GAAMAPTALDH1A1GFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117425657-A Triazolo-pyrimidine analogs for the treatment of diseases associated with inhibition of Wonna syndrome RECzochralski enzyme (WRN) 诺华股份有限公司 2024-01-19 — — CN disclosed
US-20230046859-A1 Bicyclic Compounds and their Uses NOVARTIS PHARMA AG (CH) 2023-02-16 — — 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-20230046859-A1 Bicyclic Compounds and their Uses H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, C1R, F12 GAA 2524/4885MAPT 2519/4885ALDH1A1 2542/4885

“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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