⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15154659 | 0.86 | ALDH1A1 (0.34) | — | |
| SCHEMBL10156048 | 0.80 | — | — | |
| SCHEMBL17087750 | 0.80 | — | — | |
| SCHEMBL20978350 | 0.79 | — | — | |
| SCHEMBL992932 | 0.79 | LMNA (0.48) | — | |
| SCHEMBL9906573 | 0.76 | — | — | |
| SCHEMBL12210436 | 0.74 | — | — | |
| SCHEMBL18534241 | 0.74 | TSHR (0.36) | — | |
| SCHEMBL23515324 | 0.73 | — | — | |
| SCHEMBL29877079 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8198364-B2 | Poly (vinyl alcohol) polymers, uses and preparation thereof | VALORISATION-RECHERCHE, LIMITED PARTNERSHIP (CA) | 2012-06-12 | — | — | US | disclosed |
| US-20100038297-A1 | Poly (Vinyl Alcohol) Polymers, Uses and Preparation Thereof | UNIVERSITE DE MONTREAL (CA) | 2010-02-18 | — | — | US | disclosed |