SCHEMBL20626481

SCHEMBL20626481

OCC1O[C@@H](n2cnc3c(NCc4ccccc4O)ncnc32)C[C@H]1O

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.71
SLC29A1 Q99808 2/20 0.65
ADORA3 P0DMS8 2/20 0.57
ADORA2A P29274 1/20 0.57
ADORA1 P30542 1/20 0.57
TSHR P16473 1/20 0.57
NFKB1 P19838 1/20 0.57
STAT6 P42226 1/20 0.57
GMNN O75496 1/20 0.57
BLM P54132 1/20 0.57
PMP22 Q01453 1/20 0.57
HIF1A Q16665 1/20 0.56
TP53 P04637 1/20 0.54
TDP1 Q9NUW8 1/20 0.54

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
SCHEMBL14713455 1.00 PAX8 (0.71) PAX8SLC29A1ADORA3ADORA2AADORA1
SCHEMBL20626480 1.00 PAX8 (0.71) PAX8SLC29A1ADORA3ADORA2AADORA1
SCHEMBL21874990 1.00 PAX8 (0.71) PAX8SLC29A1ADORA3ADORA2AADORA1
SCHEMBL19583035 0.90 SLC29A1 (0.64) PAX8SLC29A1ADORA3ADORA2AADORA1
SCHEMBL19583092 0.90 SLC29A1 (0.64) PAX8SLC29A1ADORA3ADORA2AADORA1
SCHEMBL21874994 0.90 SLC29A1 (0.64) PAX8SLC29A1ADORA3ADORA2AADORA1
SCHEMBL19583009 0.90 SLC29A1 (0.64) PAX8SLC29A1ADORA3ADORA2AADORA1
SCHEMBL19583152 0.90 SLC29A1 (0.64) PAX8SLC29A1ADORA3ADORA2AADORA1
SCHEMBL19582964 0.90 SLC29A1 (0.66) PAX8SLC29A1ADORA3HIF1ATP53
SCHEMBL19583084 0.89 SLC29A1 (0.63) PAX8SLC29A1HIF1A

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-10174033-B2 N6-substituted adenosine derivatives and N6-substituted adenine derivatives and uses thereof INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2019-01-08 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-10174033-B2 N6-substituted adenosine derivatives and N6-substituted adenine derivatives and uses thereof ADORA2A, ADORA3, ADORA1 PAX8 2597/4885SLC29A1 267/4885ADORA3 2/4885

“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.