SCHEMBL5386790

SCHEMBL5386790

CCCNc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 4/20 0.71
ADORA3 P0DMS8 3/20 0.71
ADORA2A P29274 3/20 0.71
LMNA P02545 1/20 0.68
TP53 P04637 1/20 0.68
ADORA2B P29275 2/20 0.68
MEN1 O00255 1/20 0.68
CYP1A2 P05177 1/20 0.68
MAPK1 P28482 1/20 0.68
KMT2A Q03164 1/20 0.68
RXFP1 Q9HBX9 1/20 0.67
PGK1 P00558 1/20 0.66
PGK2 P07205 1/20 0.66

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
SCHEMBL6262513 1.00 ADORA1 (0.71) ADORA1ADORA3ADORA2ALMNATP53
SCHEMBL6262523 1.00 ADORA1 (0.71) ADORA1ADORA3ADORA2ALMNATP53
SCHEMBL6259647 0.92 LMNA (0.71) ADORA1ADORA3ADORA2ALMNATP53
SCHEMBL5389231 0.92 LMNA (0.71) ADORA1ADORA3ADORA2ALMNATP53
SCHEMBL6259651 0.92 LMNA (0.71) ADORA1ADORA3ADORA2ALMNATP53
SCHEMBL22807222 0.91 ADORA3 (0.67) ADORA1ADORA3ADORA2ALMNATP53
SCHEMBL29489816 0.91 ADORA3 (0.67) ADORA1ADORA3ADORA2ALMNATP53
SCHEMBL4806899 0.88 PGK1 (0.85) ADORA1ADORA3ADORA2BPGK1PGK2
SCHEMBL1994057 0.87 ADORA1 (0.77) ADORA1ADORA3ADORA2ALMNATP53
SCHEMBL4134920 0.87 ADORA1 (0.77) ADORA1ADORA3ADORA2ALMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7262176-B2 Adenosine A3 receptor agonists CV THERAPEUTICS, INC. (US) 2007-08-28 US disclosed
EP-1414837-B1 ADENOSINE A3 RECEPTOR AGONISTS CV THERAPEUTICS INC (US) 2005-10-19 EP disclosed
US-20040116376-A1 Adenosine A3 receptor agonists CV THERAPEUTICS, INC. 2004-06-17 US disclosed
EP-1414837-A1 ADENOSINE A3 RECEPTOR AGONISTS CV THERAPEUTICS, INC. (US) 2004-05-06 EP disclosed
US-20030078232-A1 Adenosine receptor A3 agonists CV THERAPEUTICS, INC. 2003-04-24 US disclosed
WO-2003014137-A1 ADENOSINE A3 RECEPTOR AGONISTS CV THERAPEUTICS, INC. (US) 2003-02-20 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-20030078232-A1 Adenosine receptor A3 agonists ADORA3, ADORA2A, ADORA1 ADORA1 3/4885ADORA3 1/4885ADORA2A 2/4885

“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.