SCHEMBL2807193

SCHEMBL2807193

CCOC(=O)c1ccc2nc(-c3ccc(Oc4ccccc4)cc3)[nH]c2c1

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 7/20 0.73
SIRT2 Q8IXJ6 6/20 0.72
SIRT1 Q96EB6 5/20 0.72
SIRT3 Q9NTG7 2/20 0.72
PKN1 Q16512 1/20 0.71
PKN2 Q16513 1/20 0.71

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
SCHEMBL2802771 0.88 SIRT2 (0.71) CHEK2SIRT2SIRT1SIRT3PKN1
SCHEMBL2357098 0.88 CHEK2 (0.74) CHEK2SIRT2SIRT1SIRT3PKN1
SCHEMBL2804499 0.85 SCD (0.64) CHEK2SIRT2SIRT1SIRT3PKN1
SCHEMBL2318980 0.85 CHEK2 (1.00) CHEK2
SCHEMBL2316411 0.85 CHEK2 (0.64) CHEK2
SCHEMBL19994531 0.84 SIRT2 (0.79) CHEK2SIRT2SIRT1SIRT3PKN1
SCHEMBL19994427 0.83 PKN1 (1.00) CHEK2SIRT2SIRT1SIRT3PKN1
SCHEMBL27002575 0.83 PKN1 (1.00) CHEK2SIRT2SIRT1SIRT3PKN1
SCHEMBL17275543 0.82 PKN1 (0.65) CHEK2SIRT2SIRT1SIRT3PKN1
SCHEMBL9261347 0.81 ALDH1A1 (0.74) SIRT2SIRT1SIRT3PKN1PKN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100240580-A1 AZOLOARINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND THE USE THEREOF SANOFI-AVENTIS (FR) 2010-09-23 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-20100240580-A1 AZOLOARINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND THE USE THEREOF CYP3A43, CYP11B1, CYP11B2 CHEK2 3959/4885SIRT2 2363/4885SIRT1 1509/4885

“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.