SCHEMBL2520261

SCHEMBL2520261

COCCCOCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN(CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCOCCCOC)C(=O)c1cnc(C(N)=O)cn1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 2/20 0.40
OXTR P30559 2/20 0.32
AVPR2 P30518 1/20 0.32
SCN9A Q15858 1/20 0.32
F2 P00734 1/20 0.32
AVPR1A P37288 1/20 0.31

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
SCHEMBL2516931 0.90 SIRT6 (0.45) SIRT6OXTRAVPR2SCN9AAVPR1A
SCHEMBL2482296 0.90 SIRT6 (0.45) SIRT6OXTRAVPR2SCN9AAVPR1A
SCHEMBL2480687 0.86 SIRT6 (0.38) SIRT6
SCHEMBL590269 0.77 OXTR (0.44) SIRT6OXTRAVPR2SCN9AAVPR1A
SCHEMBL589821 0.76 SIRT6 (0.37) SIRT6
SCHEMBL589543 0.76 SIRT6 (0.37) SIRT6
SCHEMBL2133704 0.76 SIRT6 (0.37) SIRT6
SCHEMBL588733 0.70 SIRT6 (0.47) SIRT6
SCHEMBL30489397 0.69 SIRT6 (0.51) SIRT6
SCHEMBL28945656 0.68 SIRT6 (0.46) SIRT6

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-20110250139-A1 Modified Pyrazine Derivatives and Uses Thereof MEDIBEACON, INC. 2011-10-13 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-20110250139-A1 Modified Pyrazine Derivatives and Uses Thereof GLS, GLS2, PLPBP SIRT6 2338/4885OXTR 2580/4885AVPR2 65/4885

“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.