⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5719646 | 0.96 | TSHR (0.46) | — | |
| SCHEMBL1041 | 0.96 | — | — | |
| SCHEMBL4534916 | 0.92 | TSHR (0.44) | — | |
| SCHEMBL4525595 | 0.92 | TSHR (0.44) | — | |
| SCHEMBL2776375 | 0.92 | — | — | |
| SCHEMBL4530049 | 0.92 | TSHR (0.44) | — | |
| SCHEMBL4533367 | 0.92 | TSHR (0.44) | — | |
| SCHEMBL4529308 | 0.92 | TSHR (0.44) | — | |
| SCHEMBL4530283 | 0.92 | TSHR (0.44) | — | |
| SCHEMBL4528477 | 0.92 | TSHR (0.44) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2158197-A1 | METHOD FOR THE PREPARATION OF HIGH PURITY ALMOTRIPTAN | Zentiva, k.s. (CZ) | 2010-03-03 | — | — | EP | claimed |
| WO-2008151584-A1 | METHOD FOR THE PREPARATION OF HIGH PURITY ALMOTRIPTAN | ZENTIVA, A.S. (CZ) | 2008-12-18 | — | — | WO | claimed |
| CN-1219237-C | Silver halide photographic photosensitive material and treating method thereof | FUJI PHOTO FILM CO LTD (JP) | 2005-09-14 | — | — | CN | disclosed |
| CN-1296195-A | Silver halide photographic photosensitive material and treating method thereof | FUJI PHOTO FILM CO LTD (JP) | 2001-05-23 | — | — | CN | disclosed |