SCHEMBL5367077

SCHEMBL5367077

CCCCC(CCCC(=O)n1c(N)nc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1=O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 5/20 0.52
ADORA2B P29275 5/20 0.52
SLC29A1 Q99808 1/20 0.51
ADORA3 P0DMS8 2/20 0.49
ADORA1 P30542 1/20 0.49

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
SCHEMBL5352964 0.94 ADORA2A (0.50) ADORA2AADORA2BSLC29A1ADORA3ADORA1
SCHEMBL5347819 0.90 ADORA2A (0.60) ADORA2AADORA2BSLC29A1ADORA3
SCHEMBL5347799 0.90 ADORA2A (0.60) ADORA2AADORA2BSLC29A1ADORA3
SCHEMBL5356824 0.90 ADORA2A (0.60) ADORA2AADORA2BSLC29A1ADORA3
SCHEMBL5352841 0.89 ADORA2A (0.52) ADORA2AADORA2BSLC29A1ADORA3
SCHEMBL5358560 0.86 ADORA2A (0.53) ADORA2AADORA2BSLC29A1ADORA3
SCHEMBL217116 0.81 CYP2C19 (0.60) ADORA2AADORA2BADORA3ADORA1
SCHEMBL9347680 0.81 ADORA2A (0.56) ADORA2AADORA2BSLC29A1ADORA3ADORA1
SCHEMBL1611240 0.80 ADORA2A (0.57) ADORA2AADORA2BSLC29A1ADORA3ADORA1
SCHEMBL4813930 0.80 ADORA2A (0.57) ADORA2AADORA2BSLC29A1ADORA3ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7307166-B1 Oxpurine nucleosides and their congeners, and acyl, derivatives thereof, for improvement of hematopoiesis WELLSTAT THERAPEUTICS CORPORATION (US) 2007-12-11 US disclosed
US-20040235782-A1 Oxypurine nucleosides and their congeners, and acyl derivatives thereof, for improvement of hematopoiesis PRO-NEURON, INC. 2004-11-25 US disclosed
EP-1157698-A2 Treatment of inflammatory diseases with oxypurine nucleosides PRO-NEURON, INC. (US) 2001-11-28 EP disclosed
US-6060459-A Enhancing blood cell count with oxypurine nucleosides PRO-NEURON, INC. (US) 2000-05-09 US disclosed
US-6054441-A Antiinflammatory agents; treatment of bacterial, viral or fungal infections; autoimmune diseases PRO-NEURON, INC. (US) 2000-04-25 US disclosed
EP-0570519-B1 OXYPURINE NUCLEOSIDES AND THEIR CONGENERS, AND ACYL DERIVATIVES THEREOF, FOR IMPROVEMENT OF HEMATOPOIESIS PRO NEURON INC (US) 1999-05-06 EP disclosed
EP-0771204-A1 METHODS FOR TREATING SEPSIS OR INFLAMMATORY DISEASES WITH OXYPURINE NUCLEOSIDES PRO-NEURON, INC. (US) 1997-05-07 EP disclosed
EP-0570519-A4 OXYPURINE NUCLEOSIDES AND THEIR CONGENERS, AND ACYL DERIVATIVES THEREOF, FOR IMPROVEMENT OF HEMATOPOIESIS PRO NEURON INC (US) 1996-02-21 EP disclosed
EP-0570519-A1 OXYPURINE NUCLEOSIDES AND THEIR CONGENERS, AND ACYL DERIVATIVES THEREOF, FOR IMPROVEMENT OF HEMATOPOIESIS PRO-NEURON, INC. (US) 1993-11-24 EP disclosed
WO-1992013561-A1 OXYPURINE NUCLEOSIDES AND THEIR CONGENERS, AND ACYL DERIVATIVES THEREOF, FOR IMPROVEMENT OF HEMATOPOIESIS PRO-NEURON, INC. (US) 1992-08-20 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-20040235782-A1 Oxypurine nucleosides and their congeners, and acyl derivatives thereof, for improvement of hematopoiesis TPMT, NUDT1, ENTPD5 ADORA2A 61/4885ADORA2B 113/4885SLC29A1 24/4885

“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.