⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL183127 | 0.63 | — | — | |
| SCHEMBL29504063 | 0.58 | GABRP (0.31) | — | |
| SCHEMBL31373801 | 0.57 | — | — | |
| SCHEMBL3615628 | 0.56 | MEN1 (0.38) | — | |
| SCHEMBL11414250 | 0.56 | HCAR2 (0.53) | — | |
| SCHEMBL1499009 | 0.52 | — | — | |
| SCHEMBL2756774 | 0.49 | GSK3A (0.40) | — | |
| SCHEMBL369085 | 0.47 | — | — | |
| SCHEMBL4566273 | 0.43 | — | — | |
| SCHEMBL12158594 | 0.43 | CA1 (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 |
|---|---|---|---|---|---|---|---|
| US-7838585-B2 | Plastic adhesive | OATEY COMPANY (US) | 2010-11-23 | — | — | US | disclosed |
| US-20100006220-A1 | PLASTIC ADHESIVE | OATEY COMPANY (US) | 2010-01-14 | — | — | US | disclosed |
| US-7473753-B2 | Adhesive compositions and methods of using the same | OATEY CO. (US) | 2009-01-06 | — | — | US | disclosed |
| EP-0532097-A1 | Piperazinyl(sulfon)amide derivatives of camphor as oxytocin antagonists | MERCK & CO. INC. (US) | 1993-03-17 | — | — | EP | disclosed |