⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17260845 | 0.83 | ALDH1A1 (0.34) | — | |
| SCHEMBL27008059 | 0.81 | — | — | |
| SCHEMBL27008083 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL19117247 | 0.76 | LPL (0.32) | — | |
| SCHEMBL27008050 | 0.71 | ALDH1A1 (0.31) | — | |
| SCHEMBL25435839 | 0.70 | HPGD (0.31) | — | |
| SCHEMBL26814901 | 0.70 | KDM4E (0.33) | — | |
| SCHEMBL24716631 | 0.70 | FFAR1 (0.34) | — | |
| SCHEMBL25438598 | 0.68 | ALDH1A1 (0.31) | — | |
| SCHEMBL27008199 | 0.68 | SMPD3 (0.32) | — |
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-3143025-B1 | COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY | HOFFMANN LA ROCHE (CH) | 2019-10-09 | — | — | EP | disclosed |
| US-9969754-B2 | Compounds for treating spinal muscular atrophy | HOFFMANN-LA ROCHE INC. (US) | 2018-05-15 | — | — | US | disclosed |
| US-20170197990-A1 | COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY | HOFFMANN-LA ROCHE INC. (US) | 2017-07-13 | — | — | US | disclosed |
| WO-2017081111-A1 | COMPOUNDS FOR TREATING AMYOTROPHIC LATERAL SCLEROSIS | F. HOFFMANN-LA ROCHE AG (CH) | 2017-05-18 | — | — | WO | disclosed |