⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11782861 | 1.00 | — | — | |
| SCHEMBL29120874 | 0.84 | — | — | |
| SCHEMBL13734686 | 0.82 | SQLE (0.36) | — | |
| SCHEMBL1555108 | 0.78 | — | — | |
| SCHEMBL1002035 | 0.78 | — | — | |
| SCHEMBL1002034 | 0.78 | — | — | |
| SCHEMBL1555104 | 0.78 | — | — | |
| SCHEMBL8146632 | 0.77 | — | — | |
| SCHEMBL1780104 | 0.77 | — | — | |
| SCHEMBL1552504 | 0.76 | TSHR (0.44) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3984446-A | Process for preparation of terpene flavorants and novel intermediates therefor | GIVAUDAN CORPORATION (US) | 1976-10-05 | — | — | US | disclosed |
| US-3974226-A | Process for preparation of terpene flavorants and novel intermediates therefor | GIVAUDAN CORPORATION (US) | 1976-08-10 | — | — | US | disclosed |
| US-3965198-A | 4-Methylene-5-hexen-1-ol | GIVAUDAN CORPORATION (US) | 1976-06-22 | — | — | US | disclosed |
| US-3962283-A | TERPENE FLAVORANT INTERMEDIATES | GIVAUDAN CORPORATION (US) | 1976-06-08 | — | — | US | disclosed |
| US-3950430-A | Process for preparation of terpene flavorants and novel intermediates therefor | GIVAUDAN CORPORATION (US) | 1976-04-13 | — | — | US | disclosed |
| US-3939206-A | Process for preparation of terpene flavorants and novel intermediates therefor | GIVAUDAN CORPORATION (US) | 1976-02-17 | — | — | US | disclosed |
| US-3935275-A | Process for preparation of terpene flavorants and novel intermediates therefor | GIVAUDAN CORPORATION (US) | 1976-01-27 | — | — | US | disclosed |