SCHEMBL8234584

SCHEMBL8234584

COc1cccc(-c2cccc(C3(C(F)(F)F)Cc4ccccc4C(N)=N3)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.47
KCNH2 Q12809 8/20 0.47
BACE2 Q9Y5Z0 2/20 0.41

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
Trifluoroacetic Acid SCHEMBL5001600 0.93 BACE1 (0.46) BACE1KCNH2
SCHEMBL5002063 0.86 BACE1 (0.43) BACE1KCNH2BACE2
SCHEMBL8234379 0.85 BACE1 (0.45) BACE1KCNH2
SCHEMBL8240965 0.85 CHEK2 (0.47) BACE1KCNH2
SCHEMBL14010719 0.82 BACE1 (0.47) BACE1KCNH2BACE2
Trifluoroacetic Acid SCHEMBL5001534 0.82 BACE1 (0.43) BACE1KCNH2
SCHEMBL8240648 0.82 BACE1 (0.60) BACE1KCNH2
SCHEMBL8240666 0.82 BACE1 (0.58) BACE1KCNH2BACE2
Trifluoroacetic Acid SCHEMBL5001495 0.82 BACE1 (0.44) BACE1KCNH2
Trifluoroacetic Acid SCHEMBL5007768 0.81 BACE1 (0.42) BACE1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293709-A1 Novel 2-Amino-Heterocycles Useful in the Treatment of Abeta-Related Pathologies ASTRAZENECA AB (SE) 2008-11-27 US disclosed
US-20080293709-A1 Novel 2-Amino-Heterocycles Useful in the Treatment of Abeta-Related Pathologies ASTRAZENECA AB (SE) 2008-11-27 US disclosed
WO-2007058583-A2 NOVEL 2-AMINO-HETEROCYCLES USEFUL IN THE TREATMENT OF ABETA-RELATED PATHOLOGIES ASTRAZENECA AB (SE) 2007-05-24 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-20080293709-A1 Novel 2-Amino-Heterocycles Useful in the Treatment of Abeta-Related Pathologies PSEN2, APP, PSEN1 BACE1 4/4885KCNH2 2421/4885BACE2 5/4885

“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.