SCHEMBL10284145

SCHEMBL10284145

Nc1ncnc2c1ncn2CO[C@H](CO)C(O)CO

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AHCY P23526 11/20 0.60
▸ ADORA2A P29274 6/20 0.60
▸ ADORA1 P30542 4/20 0.55
▸ ALDH1A1 P00352 1/20 0.51
▸ PI4KA P42356 1/20 0.50
▸ PI4K2B Q8TCG2 1/20 0.50
▸ PI4K2A Q9BTU6 1/20 0.50
▸ PI4KB Q9UBF8 1/20 0.50
▸ ADORA2B P29275 1/20 0.48

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
SCHEMBL14472999 1.00 AHCY (0.60) AHCYADORA2AADORA1ALDH1A1PI4KA
SCHEMBL14139510 0.91 AHCY (0.56) AHCYADORA2AADORA1ALDH1A1PI4KA
SCHEMBL14379019 0.89 ADORA2A (0.60) AHCYADORA2AADORA1ALDH1A1PI4KA
SCHEMBL14472882 0.88 AHCY (0.56) AHCYADORA2AADORA1ALDH1A1PI4KA
SCHEMBL15606513 0.86 ADORA2A (0.57) AHCYADORA2AADORA1ALDH1A1PI4KA
SCHEMBL91112 0.85 FDPS (0.48) AHCYADORA2AADORA1ALDH1A1
SCHEMBL30292318 0.84 ADORA2A (0.64) AHCYADORA2AADORA1ALDH1A1PI4KA
SCHEMBL4093935 0.84 ADORA2A (0.64) AHCYADORA2AADORA1ALDH1A1PI4KA
SCHEMBL10642386 0.84 CCNE1 (0.51) AHCYADORA2AADORA1ALDH1A1
SCHEMBL13625720 0.82 BLM (0.45) AHCYADORA2AADORA1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8283369-B2 Compounds and compositions and methods of use ARDEA BIOSCIENCES. INC. (US) 2012-10-09 — — US disclosed
US-8173690-B2 Compounds, compositions and methods of using same for modulating uric acid levels ARDEA BIOSCIENCES, INC. (US) 2012-05-08 — — US disclosed
US-20110268801-A1 NOVEL COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2011-11-03 — — US disclosed
US-20100286084-A1 Oligomer-Nucleoside Phosphate Conjugates NEKTAR THERAPEUTICS (US) 2010-11-11 — — US disclosed
US-20100056464-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF USING SAME FOR MODULATING URIC ACID LEVELS ARDEA BIOSCIENCES (US) 2010-03-04 — — 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 (3 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-20110268801-A1 NOVEL COMPOUNDS AND COMPOSITIONS AND METHODS OF USE XDH, PON1, GLS AHCY 493/4885ADORA2A 306/4885ADORA1 916/4885
US-20100286084-A1 Oligomer-Nucleoside Phosphate Conjugates ENTPD5, SLC29A2, SLC29A1 AHCY 1481/4885ADORA2A 93/4885ADORA1 115/4885
US-20100056464-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF USING SAME FOR MODULATING URIC ACID LEVELS XDH, PON1, OAT AHCY 99/4885ADORA2A 211/4885ADORA1 614/4885

“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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