SCHEMBL13855523

SCHEMBL13855523

C[C@H]1O[C@@H](n2c(NCc3ccccc3)nc3c(N)nc(OC4CCCC4)nc32)[C@H](O)[C@@H]1O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC28A2 O43868 11/20 0.51
HSPA8 P11142 5/20 0.51
ADORA2A P29274 2/20 0.45
ADORA2B P29275 2/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HSPA5 P11021 2/20 0.44
FBP1 P09467 1/20 0.44

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
SCHEMBL3877828 0.92 SLC28A2 (0.55) SLC28A2HSPA8ADORA2AADORA2BHSPA5
SCHEMBL13855521 0.92 SLC28A2 (0.55) SLC28A2HSPA8ADORA2AADORA2BHSPA5
SCHEMBL3880076 0.85 ADK (0.42) SLC28A2HSPA8ADORA2AADORA2BMEN1
SCHEMBL13855522 0.85 HSPA8 (0.60) HSPA8ADORA2AADORA2BHSPA5FBP1
SCHEMBL13855561 0.81 HSPA8 (0.48) HSPA8ADORA2AADORA2BHSPA5FBP1
SCHEMBL4031221 0.80 ADORA2A (0.50) HSPA8ADORA2AADORA2BHSPA5FBP1
SCHEMBL13855562 0.79 ADORA2A (0.49) HSPA8ADORA2AADORA2BHSPA5FBP1
SCHEMBL3880247 0.78 ADORA2A (0.48) HSPA8ADORA2AADORA2BHSPA5FBP1
SCHEMBL4239470 0.78 ADORA2A (0.48) HSPA8ADORA2AADORA2BHSPA5FBP1
SCHEMBL4239465 0.78 ADORA2A (0.48) HSPA8ADORA2AADORA2BHSPA5FBP1

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 SLC28A2 61/4885HSPA8 4053/4885ADORA2A 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.