⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31020055 | 1.00 | — | — | |
| SCHEMBL3830 | 0.81 | — | — | |
| SCHEMBL30361126 | 0.81 | — | — | |
| SCHEMBL1538139 | 0.79 | TAAR1 (0.54) | — | |
| SCHEMBL4933342 | 0.79 | TAAR1 (0.54) | — | |
| SCHEMBL931383 | 0.77 | TAAR1 (0.63) | — | |
| SCHEMBL30186558 | 0.77 | TAAR1 (0.63) | — | |
| SCHEMBL12727553 | 0.77 | — | — | |
| SCHEMBL3300303 | 0.75 | TAAR1 (0.60) | — | |
| SCHEMBL3371633 | 0.75 | TAAR1 (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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024067819-A1 | PIPERIDINE-CONTAINING POLYCYCLIC DERIVATIVE MODULATOR, PREPARATION METHOD THEREFOR, AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2024-04-04 | — | — | WO | disclosed |
| US-20110097320-A1 | 4-AMINOQUINAZOLINE DERIVATIVES AND METHODS OF USE THEREOF | CONCERT PHARMACEUTICALS INC. (US) | 2011-04-28 | — | — | US | disclosed |
| US-20110053964-A1 | 4-AMINOQUINAZOLINE DERIVATIVES AND METHODS OF USE THEREOF | CONCERT PHARMACEUTICALS, INC. | 2011-03-03 | — | — | US | disclosed |
| US-20090149544-A1 | Alpha-aminoamide derivatives | CONCERT PHARMACEUTICALS, INC. (US) | 2009-06-11 | — | — | US | disclosed |
| US-20090149544-A1 | Alpha-aminoamide derivatives | CONCERT PHARMACEUTICALS, INC. (US) | 2009-06-11 | — | — | US | disclosed |
| WO-2009054964-A1 | ALPHA-AMINOAMIDE DERIVATIVES | CONCERT PHARMACEUTICALS, INC. (US) | 2009-04-30 | — | — | WO | disclosed |