⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10817008 | 0.74 | GOT1 (0.41) | — | |
| SCHEMBL1894224 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL11820325 | 0.73 | GOT1 (0.41) | — | |
| SCHEMBL3946158 | 0.73 | — | — | |
| SCHEMBL28013036 | 0.73 | — | — | |
| SCHEMBL11823547 | 0.70 | LMNA (0.43) | — | |
| SCHEMBL11826081 | 0.70 | GOT1 (0.38) | — | |
| SCHEMBL15789458 | 0.68 | GOT1 (0.36) | — | |
| Hydrochloric Acid SCHEMBL11824418 | 0.68 | GOT1 (0.38) | — | |
| SCHEMBL29661956 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101981035-B | Salts of triazoles as PAR1 inhibitors, their preparation and their use as medicaments | SANOFI AVENTIS | 2013-08-28 | — | — | CN | disclosed |
| US-8188083-B2 | Triazolopyridazines | ABBOTT LABORATORIES (US) | 2012-05-29 | — | — | US | disclosed |
| EP-2170337-A1 | NOVEL TRIAZOLOPYRIDAZINES | Abbott Laboratories (US) | 2010-04-07 | — | — | EP | disclosed |
| US-20090270402-A1 | Novel triazolopyridazines | ABBVIE INC. | 2009-10-29 | — | — | US | disclosed |
| WO-2009005675-A1 | NOVEL TRIAZOLOPYRIDAZINES | ABBOTT LABORATORIES (US) | 2009-01-08 | — | — | WO | disclosed |