SCHEMBL6690627

SCHEMBL6690627

Nc1ncnc2ncn(COCCO)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 5/20 0.56
USP2 O75604 1/20 0.44
PNP P00491 1/20 0.44
TSHR P16473 1/20 0.44
EDNRA P25101 1/20 0.44
HTR2A P28223 1/20 0.44
RECQL P46063 1/20 0.44
BLM P54132 1/20 0.44
HBB P68871 1/20 0.44
HSD17B10 Q99714 1/20 0.44
EGFR P00533 1/20 0.44
SRC P12931 1/20 0.44
KDR P35968 1/20 0.44
TEK Q02763 1/20 0.44
ADORA1 P30542 2/20 0.42
ENPP1 P22413 2/20 0.39
PIK3CD O00329 2/20 0.37
NT5E P21589 1/20 0.36
DNMT3A Q9Y6K1 1/20 0.36
FGFR1 P11362 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
SCHEMBL6700949 0.85 ADORA2A (0.56) ADORA2AEGFRSRCKDRTEK
SCHEMBL17369291 0.83 ADORA2A (0.57) ADORA2AEGFRSRCKDRTEK
Hydrochloric Acid SCHEMBL29799380 0.82 ADORA2A (0.56) ADORA2AEGFRSRCKDRTEK
Hydrochloric Acid SCHEMBL17362936 0.82 ADORA2A (0.56) ADORA2AEGFRSRCKDRTEK
SCHEMBL4815870 0.80 ADORA2A (0.71) ADORA2ATSHREGFRSRCKDR
SCHEMBL1665301 0.79 ADORA2A (0.69) ADORA2AEGFRSRCKDRTEK
SCHEMBL6691792 0.78 NSD3 (0.52) ADORA2AADORA1
SCHEMBL2293269 0.77 ADORA2A (0.66) ADORA2AUSP2PNPTSHREDNRA
SCHEMBL8140765 0.74 USP2 (0.37) ADORA2AUSP2PNPTSHREDNRA
SCHEMBL1665392 0.74 ADORA2A (0.71) ADORA2AEGFRSRCKDRTEK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6825348-B2 Antiviral compounds ACADEMIA SINICA (TW) 2004-11-30 US disclosed
US-20040002475-A1 Dna genome ACADEMIA SINICA (TW) 2004-01-01 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-20040002475-A1 Dna genome DNA2, OGG1, UNG ADORA2A 122/4885USP2 2435/4885PNP 36/4885

“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.