SCHEMBL20626432

SCHEMBL20626432

CCCOC[C@H]1O[C@@H](n2cnc3c(NCc4ccc5c(c4)OCO5)ncnc32)C(O)C1O

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 6/20 0.64
PRKAG1 P54619 1/20 0.57
PRKAA1 Q13131 1/20 0.57
PRKAB1 Q9Y478 1/20 0.57
SLC29A1 Q99808 2/20 0.55
DNPH1 O43598 1/20 0.54
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
SCHEMBL20626433 1.00 ADORA3 (0.64) ADORA3PRKAG1PRKAA1PRKAB1SLC29A1
SCHEMBL14714024 1.00 ADORA3 (0.64) ADORA3PRKAG1PRKAA1PRKAB1SLC29A1
SCHEMBL14713295 1.00 ADORA3 (0.64) ADORA3PRKAG1PRKAA1PRKAB1SLC29A1
SCHEMBL14714087 0.88 ADORA3 (0.60) ADORA3PRKAG1PRKAA1PRKAB1SLC29A1
SCHEMBL20626363 0.87 PRKAG1 (0.75) ADORA3PRKAG1PRKAA1PRKAB1SLC29A1
SCHEMBL27898344 0.87 PRKAG1 (0.75) ADORA3PRKAG1PRKAA1PRKAB1SLC29A1
SCHEMBL14714098 0.87 PRKAG1 (0.75) ADORA3PRKAG1PRKAA1PRKAB1SLC29A1
SCHEMBL20626299 0.87 PRKAG1 (0.75) ADORA3PRKAG1PRKAA1PRKAB1SLC29A1
SCHEMBL14713285 0.87 PRKAG1 (0.75) ADORA3PRKAG1PRKAA1PRKAB1SLC29A1
SCHEMBL1798219 0.86 PRKAG1 (0.59) ADORA3PRKAG1PRKAA1PRKAB1SLC29A1

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 ADORA3 2/4885PRKAG1 115/4885PRKAA1 341/4885

“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.