⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8663893 | 0.97 | — | — | |
| Sulfuric Acid SCHEMBL31317649 | 0.88 | KDM4E (0.41) | — | |
| SCHEMBL18532680 | 0.83 | — | — | |
| SCHEMBL1195090 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL4771387 | 0.81 | — | — | |
| SCHEMBL9841009 | 0.79 | NAAA (0.50) | — | |
| Hydrochloric Acid SCHEMBL9841041 | 0.78 | NAAA (0.48) | — | |
| SCHEMBL22571321 | 0.75 | HCAR2 (0.37) | — | |
| SCHEMBL643463 | 0.75 | — | — | |
| SCHEMBL5297609 | 0.74 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2438069-A1 | SUBSTITUTED [1,2,4]TRIAZOLO[1,5-A]PYRIMIDINES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS | NeuroSearch A/S (DK) | 2012-04-11 | — | — | EP | claimed |
| WO-2010112485-A1 | SUBSTITUTED [1,2,4]TRIAZOLO[1,5-a]PYRIMIDINES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS | NEUROSEARCH A/S (DK) | 2010-10-07 | — | — | WO | claimed |
| EP-2438069-A1 | SUBSTITUTED [1,2,4]TRIAZOLO[1,5-A]PYRIMIDINES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS | NeuroSearch A/S (DK) | 2012-04-11 | — | — | EP | disclosed |
| WO-2010112484-A1 | SUBSTITUTED [1,2,4]TRIAZOLO[1,5-a]PYRIMIDINES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS | NEUROSEARCH A/S (DK) | 2010-10-07 | — | — | WO | disclosed |
| WO-2010112485-A1 | SUBSTITUTED [1,2,4]TRIAZOLO[1,5-a]PYRIMIDINES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS | NEUROSEARCH A/S (DK) | 2010-10-07 | — | — | WO | disclosed |