SCHEMBL13855522

SCHEMBL13855522

CNc1nc2c(N)nc(OC3CCCC3)nc2n1[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSPA8 P11142 2/20 0.60
HSPA5 P11021 5/20 0.49
ADORA2A P29274 3/20 0.48
ADORA2B P29275 3/20 0.48
RXFP1 Q9HBX9 1/20 0.45
FBP1 P09467 1/20 0.44
AMD1 P17707 2/20 0.38
ADORA3 P0DMS8 1/20 0.37
HSPA2 P54652 1/20 0.36
ADK P55263 1/20 0.35

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
SCHEMBL13855561 0.89 HSPA8 (0.48) HSPA8HSPA5ADORA2AADORA2BRXFP1
SCHEMBL4031221 0.89 ADORA2A (0.50) HSPA8HSPA5ADORA2AADORA2BFBP1
SCHEMBL13855562 0.88 ADORA2A (0.49) HSPA8HSPA5ADORA2AADORA2BFBP1
SCHEMBL3880247 0.87 ADORA2A (0.48) HSPA8HSPA5ADORA2AADORA2BFBP1
SCHEMBL4239470 0.87 ADORA2A (0.48) HSPA8HSPA5ADORA2AADORA2BFBP1
SCHEMBL4239465 0.87 ADORA2A (0.48) HSPA8HSPA5ADORA2AADORA2BFBP1
SCHEMBL13855523 0.85 SLC28A2 (0.51) HSPA8HSPA5ADORA2AADORA2BFBP1
SCHEMBL13855521 0.83 SLC28A2 (0.55) HSPA8HSPA5ADORA2AADORA2BFBP1
SCHEMBL3877828 0.83 SLC28A2 (0.55) HSPA8HSPA5ADORA2AADORA2BFBP1
SCHEMBL3879857 0.78 ADORA2A (0.75) ADORA2AADORA2BADORA3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090118220-A1 SUBSTITUTED ADENINES AND THE USES THEREOF ASTRAZENECA AB (SE) 2009-05-07 US disclosed
US-20090118220-A1 SUBSTITUTED ADENINES AND THE USES THEREOF ASTRAZENECA AB (SE) 2009-05-07 US disclosed
WO-2007113538-A1 SUBSTITUTED ADENINES AND THE USES THEREOF ASTRAZENECA AB (SE) 2007-10-11 WO 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-20090118220-A1 SUBSTITUTED ADENINES AND THE USES THEREOF HPRT1, APRT, NUDT1 HSPA8 4053/4885HSPA5 2749/4885ADORA2A 37/4885

“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.