⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29626253 | 0.97 | — | — | |
| SCHEMBL5218006 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL853727 | 0.76 | TACR1 (0.30) | — | |
| SCHEMBL29572238 | 0.74 | — | — | |
| SCHEMBL30017903 | 0.68 | — | — | |
| SCHEMBL30514530 | 0.67 | HPGD (0.33) | — | |
| SCHEMBL30485195 | 0.67 | HPGD (0.32) | — | |
| SCHEMBL29963037 | 0.66 | — | — | |
| SCHEMBL31258311 | 0.66 | — | — | |
| SCHEMBL29602485 | 0.66 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4013736-A1 | BRANCHED ALKANES AND PROCESS FOR PREPARING SAME | L'OREAL (FR) | 2022-06-22 | — | — | EP | claimed |
| US-20220340503-A1 | BRANCHED ALKANES AND PROCESS FOR PREPARING SAME | OREAL (FR) | 2022-10-27 | — | — | US | disclosed |
| CN-114502523-A | Branched alkanes and process for their preparation | 欧莱雅 | 2022-05-13 | — | — | CN | disclosed |