⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28849731 | 0.82 | SMN1; SMN2 (0.42) | — | |
| SCHEMBL2719363 | 0.79 | SMN1; SMN2 (0.60) | — | |
| SCHEMBL433157 | 0.78 | — | — | |
| SCHEMBL223785 | 0.74 | — | — | |
| Ether SCHEMBL8158792 | 0.72 | ALDH1A1 (0.48) | — | |
| SCHEMBL6429215 | 0.72 | ALDH1A1 (0.53) | — | |
| SCHEMBL537329 | 0.72 | ALDH1A1 (0.46) | — | |
| SCHEMBL537328 | 0.72 | ALDH1A1 (0.46) | — | |
| SCHEMBL6559491 | 0.71 | — | — | |
| SCHEMBL488961 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2449016-A1 | POLYMERS CONTAINING HETEROCYCLIC 3-RING COMPOUNDS AND IODINE-CONTAINING COMPOUNDS | Lanxess Deutschland GmbH (DE) | 2012-05-09 | — | — | EP | disclosed |
| EP-2440043-A1 | INORGANIC CARRIER MATERIALS CONTAINING HETEROCYCLIC 3-RING COMPOUNDS | Lanxess Deutschland GmbH (DE) | 2012-04-18 | — | — | EP | disclosed |
| WO-2011000794-A1 | POLYMERS CONTAINING HETEROCYCLIC 3-RING COMPOUNDS AND IODINE-CONTAINING COMPOUNDS | LANXESS DEUTSCHLAND GMBH (DE) | 2011-01-06 | — | — | WO | disclosed |
| WO-2010142790-A1 | INORGANIC CARRIER MATERIALS CONTAINING HETEROCYCLIC 3-RING COMPOUNDS | LANXESS DEUTSCHLAND GMBH (DE) | 2010-12-16 | — | — | WO | disclosed |
| EP-1037532-A1 | STABILIZED COMPOSITION CONTAINING HALOPROPYNYL COMPOUNDS | Troy Technology Corporation, Inc. (US) | 2000-09-27 | — | — | EP | disclosed |
| WO-1999029176-A1 | STABILIZED COMPOSITION CONTAINING HALOPROPYNYL COMPOUNDS | TROY TECHNOLOGY CORPORATION, INC. (US) | 1999-06-17 | — | — | WO | disclosed |