SCHEMBL6044690

SCHEMBL6044690

[CH2]C#Cc1nn([C@H]2CC(O)[C@@H](CO)O2)c2ncnc(N)c12

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ATG7 O95352 19/20 0.51
ADORA3 P0DMS8 1/20 0.48
ADORA2A P29274 1/20 0.48

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
SCHEMBL5087918 1.00 ATG7 (0.51) ATG7ADORA3ADORA2A
SCHEMBL13669400 0.91 ATG7 (0.50) ATG7ADORA3ADORA2A
SCHEMBL887667 0.85 ATG7 (0.53) ATG7
SCHEMBL1512938 0.83 ATG7 (0.52) ATG7
SCHEMBL532323 0.83 ATG7 (0.52) ATG7
SCHEMBL6579936 0.83 ATG7 (0.52) ATG7
SCHEMBL12762314 0.83 ATG7 (0.54) ATG7
SCHEMBL14038325 0.83 ATG7 (0.57) ATG7
SCHEMBL20141774 0.82 ATG7 (0.71) ATG7
SCHEMBL20142486 0.82 ATG7 (0.71) ATG7

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-20060009628-A1 MODIFIED OLIGONUCLEOTIDES FOR MISMATCH DISCRIMINATION ELITECHGROUP, INC. 2006-01-12 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-20060009628-A1 MODIFIED OLIGONUCLEOTIDES FOR MISMATCH DISCRIMINATION MSH2, RNGTT, DCLRE1B ATG7 4773/4885ADORA3 374/4885ADORA2A 779/4885

“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.