SCHEMBL5665592

SCHEMBL5665592

CNc1cc2ncnn2c(N)n1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EGLN2 Q96KS0 9/20 0.35
▸ NUDT1 P36639 5/20 0.35
▸ ALDH1A1 P00352 1/20 0.33
▸ NOS3 P29474 1/20 0.32
▸ NOS2 P35228 1/20 0.32
▸ HTR6 P50406 1/20 0.31
▸ DYRK1A Q13627 1/20 0.31

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
SCHEMBL5667663 0.76 DYRK1A (0.42) EGLN2ALDH1A1DYRK1A
SCHEMBL21731043 0.73 EGLN2 (0.38) EGLN2DYRK1A
SCHEMBL30428953 0.68 ADORA3 (0.44) ALDH1A1
SCHEMBL5315895 0.68 KDM4E (0.54) EGLN2ALDH1A1
SCHEMBL11003960 0.67 ALDH1A1 (0.44) ALDH1A1
SCHEMBL29781538 0.66 KDM4E (0.52) EGLN2ALDH1A1DYRK1A
SCHEMBL23055294 0.64 ALDH1A1 (0.42) EGLN2ALDH1A1
SCHEMBL29781504 0.64 CSNK1A1 (0.38) EGLN2
SCHEMBL3547481 0.62 EGLN2 (0.45) EGLN2
SCHEMBL9679567 0.62 DYRK1A (0.44) EGLN2ALDH1A1DYRK1A

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-20070010522-A1 Triazolo[1,5-c]pyrimidines and pyrazolo[1,5-c]pyrimidines useful as a2a adenosine receptor antagonists BIOGEN IDEC MA INC. 2007-01-11 — — 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 (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-20070010522-A1 Triazolo[1,5-c]pyrimidines and pyrazolo[1,5-c]pyrimidines useful as a2a adenosine receptor antagonists ADORA2A, ADORA3, ADORA1 EGLN2 4479/4885NUDT1 75/4885ALDH1A1 407/4885

“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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