SCHEMBL6945387

SCHEMBL6945387

CSc1ncnc2nc([C@@H]3O[C@H](CO)[C@@H](O)[C@@]3(C)O)[nH]c12

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.35
TP53 P04637 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.34
ADORA3 P0DMS8 3/20 0.31
ADORA2B P29275 1/20 0.31
ADORA1 P30542 1/20 0.31
ADK P55263 1/20 0.30

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
SCHEMBL6381869 0.85 ADORA2A (0.36) ADORA2AADORA3ADORA2BADORA1
SCHEMBL5813820 0.76 GRIN2B (0.36) ADORA2A
SCHEMBL6887365 0.72 TP53 (0.35) TP53SMN1; SMN2HSD17B10
SCHEMBL17364300 0.71 ADORA2A (0.38) ADORA2ASMN1; SMN2ADORA1
SCHEMBL6880481 0.71 SMN1; SMN2 (0.34) TP53SMN1; SMN2HSD17B10ADK
Ribose (Furanose) SCHEMBL5179410 0.65 TP53 (0.61) TP53SMN1; SMN2HSD17B10
SCHEMBL6378951 0.65 MAPT (0.43) SMN1; SMN2HSD17B10
SCHEMBL6381734 0.65 KDM4E (0.39) ADORA2ASMN1; SMN2
SCHEMBL4426228 0.64 ADORA2A (0.72) ADORA2ATP53SMN1; SMN2ADORA3ADORA2B
SCHEMBL13598771 0.64 ADORA2A (0.72) ADORA2ATP53SMN1; SMN2ADORA3ADORA2B

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-20040063658-A1 Nucleoside derivatives for treating hepatitis C virus infection GENELABS TECHNOLOGIES, INC. 2004-04-01 US claimed

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-20040063658-A1 Nucleoside derivatives for treating hepatitis C virus infection HAVCR2, PNP, NTPCR ADORA2A 174/4885TP53 1069/4885SMN1; SMN2 4031/4885

“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.