SCHEMBL8220368

SCHEMBL8220368

Cc1cccc(Cn2nc3c4ccccc4nc(N)n3c2=O)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 13/20 0.52
▸ ADORA1 P30542 2/20 0.49
▸ MAPT P10636 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ TP53 P04637 1/20 0.46
▸ APP P05067 1/20 0.46
▸ ASAH1 Q13510 1/20 0.44
▸ TDP1 Q9NUW8 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL13368130 0.89 ADORA2A (0.53) ADORA2AADORA1
SCHEMBL8221822 0.88 ADORA2A (0.63) ADORA2AADORA1ALDH1A1
SCHEMBL8223342 0.88 ADORA2A (0.55) ADORA2AADORA1
SCHEMBL8217490 0.87 ADORA2A (0.52) ADORA2AADORA1MAPTAPPL3MBTL1
SCHEMBL8223855 0.87 ADORA2A (0.64) ADORA2AADORA1MAPTAPP
SCHEMBL8221184 0.86 ADORA2A (0.56) ADORA2AADORA1
SCHEMBL8221511 0.86 ADORA2A (0.54) ADORA2AADORA1MAPTALDH1A1APP
SCHEMBL8221513 0.84 ADORA2A (0.49) ADORA2AADORA1ALDH1A1
SCHEMBL8212757 0.84 ADORA2A (0.49) ADORA2AADORA1MAPTTP53APP
SCHEMBL13341606 0.82 KMT2A (0.54) ADORA2AADORA1TDP1

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-7713985-B2 Adenosine Aa2 receptor antagonists SCHERING CORPORATION (US) 2010-05-11 — — US disclosed
US-7713985-B2 Adenosine Aa2 receptor antagonists SCHERING CORPORATION (US) 2010-05-11 — — US disclosed
EP-2038285-B1 ADENOSINE A2A RECEPTOR ANTAGONISTS SCHERING CORP (US) 2010-02-17 — — EP disclosed
US-20080255156-A1 ADENOSINE A2A RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LLC 2008-10-16 — — US disclosed
US-20080255156-A1 ADENOSINE A2A RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LLC 2008-10-16 — — US disclosed
WO-2008002596-A2 ADENOSINE A2A RECEPTOR ANTAGONISTS SCHERING CORPORATION (US) 2008-01-03 — — 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-20080255156-A1 ADENOSINE A2A RECEPTOR ANTAGONISTS ADORA3, ADORA2A, ADORA1 ADORA2A 2/4885ADORA1 3/4885MAPT 3635/4885

“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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