⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2821051 | 0.79 | — | — | |
| SCHEMBL13500045 | 0.79 | ALDH1A1 (0.42) | — | |
| SCHEMBL29059372 | 0.76 | TSHR (0.39) | — | |
| SCHEMBL990916 | 0.76 | ALDH1A1 (0.41) | — | |
| SCHEMBL12453677 | 0.75 | — | — | |
| SCHEMBL991387 | 0.75 | ALDH1A1 (0.45) | — | |
| SCHEMBL12901768 | 0.75 | ALDH1A1 (0.40) | — | |
| SCHEMBL991393 | 0.74 | — | — | |
| SCHEMBL3969819 | 0.73 | ALDH1A1 (0.43) | — | |
| SCHEMBL12255004 | 0.73 | ALDH1A1 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9096713-B2 | Method for the phosphine-initialized production of hyperbranched polyols | BASF SE (DE) | 2015-08-04 | — | — | US | disclosed |
| EP-2448994-B1 | METHOD FOR THE PHOSPHINE-INITIALIZED PRODUCTION OF HYPERBRANCHED POLYOLS | BASF SE (DE) | 2013-08-14 | — | — | EP | disclosed |
| EP-2448994-A1 | METHOD FOR THE PHOSPHINE-INITIALIZED PRODUCTION OF HYPERBRANCHED POLYOLS | BASF SE (DE) | 2012-05-09 | — | — | EP | disclosed |
| US-20120101308-A1 | METHOD FOR THE PHOSPHINE-INITIALIZED PRODUCTION OF HYPERBRANCHED POLYOLS | BASF SE (DE) | 2012-04-26 | — | — | US | disclosed |
| WO-2011000854-A1 | METHOD FOR THE PHOSPHINE-INITIALIZED PRODUCTION OF HYPERBRANCHED POLYOLS | BASF SE (DE) | 2011-01-06 | — | — | WO | disclosed |
| US-3968316-A | Process for the surface treatment of unsaturated rubber | NIPPON ZEON CO., LTD. (JA) | 1976-07-06 | — | — | US | disclosed |