SCHEMBL20626431

SCHEMBL20626431

O=[N+]([O-])c1ccc(CNc2ncnc3c2ncn3C2OC(CO)C(O)C2O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 12/20 1.00
▸ TP53 P04637 1/20 0.75
▸ ADORA3 P0DMS8 1/20 0.75
▸ TDP1 Q9NUW8 1/20 0.75

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
SCHEMBL638750 1.00 SLC29A1 (1.00) SLC29A1TP53ADORA3TDP1
SCHEMBL638749 1.00 SLC29A1 (1.00) SLC29A1TP53ADORA3TDP1
SCHEMBL14713263 1.00 SLC29A1 (1.00) SLC29A1TP53ADORA3TDP1
SCHEMBL3895881 1.00 SLC29A1 (1.00) SLC29A1TP53ADORA3TDP1
SCHEMBL638628 0.91 SLC29A1 (0.84) SLC29A1TP53ADORA3TDP1
SCHEMBL638629 0.91 SLC29A1 (0.84) SLC29A1TP53ADORA3TDP1
SCHEMBL640539 0.90 SLC29A1 (0.81) SLC29A1TP53ADORA3TDP1
SCHEMBL640540 0.90 SLC29A1 (0.81) SLC29A1TP53ADORA3TDP1
SCHEMBL8572281 0.89 SLC29A1 (0.80) SLC29A1ADORA3
SCHEMBL8572278 0.89 SLC29A1 (0.80) SLC29A1ADORA3

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 SLC29A1 267/4885TP53 3945/4885ADORA3 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.

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