⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17629024 | 0.71 | — | — | |
| SCHEMBL4582773 | 0.67 | — | — | |
| SCHEMBL7763082 | 0.66 | — | — | |
| SCHEMBL17633096 | 0.58 | — | — | |
| SCHEMBL18797488 | 0.58 | — | — | |
| SCHEMBL29797161 | 0.58 | TSHR (0.36) | — | |
| SCHEMBL10596386 | 0.56 | — | — | |
| SCHEMBL11689335 | 0.54 | CYP19A1 (0.30) | — | |
| SCHEMBL7126291 | 0.53 | — | — | |
| SCHEMBL6847784 | 0.52 | — | — |
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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6369248-B1 | HYDROXY ESTERS FOR PERFUMES | GIVAUDAN SA (CH) | 2002-04-09 | — | — | US | claimed |
| US-6262287-B1 | POLYSILOXANE OLIGOMERS | GIVAUDAN-ROURE (INTERNATIONAL) SA (CH) | 2001-07-17 | — | — | US | claimed |
| EP-0989970-A1 | FRAGRANCE PRECURSOR COMPOUNDS | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 2000-04-05 | — | — | EP | claimed |
| EP-0980863-A1 | Oxime carboxylic acid derivatives | Givaudan Roure (International) S.A. (CH) | 2000-02-23 | — | — | EP | claimed |
| EP-0953562-A1 | Beta, gamma-unsaturated delta-keto esters | Givaudan Roure (International) S.A. (CH) | 1999-11-03 | — | — | EP | claimed |
| WO-1998058899-A1 | FRAGRANCE PRECURSOR COMPOUNDS | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1998-12-30 | — | — | WO | claimed |
| EP-0878497-A2 | Fragrance precursor compounds | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1998-11-18 | — | — | EP | claimed |
| US-20180265805-A1 | RELEASE OF ODORIFEROUS SUBSTANCES FROM MICROCAPSULES | HENKEL AG & CO. KGAA (DE) | 2018-09-20 | — | — | US | disclosed |
| EP-3350306-A1 | RELEASE OF ODORIFEROUS SUBSTANCES FROM MICROCAPSULES | Henkel AG & Co. KGaA (DE) | 2018-07-25 | — | — | EP | disclosed |
| US-9981937-B2 | Orthoformic acid esters as pro-fragrances | HENKEL AG & CO. KGAA (DE) | 2018-05-29 | — | — | US | disclosed |
| US-20170349565-A1 | ORTHOFORMIC ACID ESTERS AS PRO-FRAGRANCES | HENKEL AG & CO. KGAA (DE) | 2017-12-07 | — | — | US | disclosed |
| EP-3233821-A1 | ORTHOFORMIC ACID ESTERS AS PRO-FRAGRANCES | Henkel AG & Co. KGaA (DE) | 2017-10-25 | — | — | EP | disclosed |
| WO-2017045893-A1 | RELEASE OF ODORIFEROUS SUBSTANCES FROM MICROCAPSULES | HENKEL AG & CO. KGAA (DE) | 2017-03-23 | — | — | WO | disclosed |
| EP-0952142-A1 | Compounds with protected hydroxy groups | Givaudan Roure (International) S.A. (CH) | 1999-10-27 | — | — | EP | disclosed |
| EP-0936211-A2 | Aryl-acrylic acid esters useful as precursors for organoleptic compounds | Givaudan Roure (International) S.A. (CH) | 1999-08-18 | — | — | EP | disclosed |
| EP-0911315-A1 | Beta-ketoester | Givaudan Roure (International) S.A. (CH) | 1999-04-28 | — | — | EP | disclosed |
| EP-0887336-A1 | Precursor Compounds | GIVAUDAN-ROURE (INTERNATIONAL) SA (CH) | 1998-12-30 | — | — | EP | disclosed |
| EP-0887338-A1 | Carbonates for the delivery of aldehydes and/or ketones | GIVAUDAN-ROURE (INTERNATIONAL) SA (CH) | 1998-12-30 | — | — | EP | disclosed |
| EP-0816322-A1 | Fragrance precursors | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1998-01-07 | — | — | EP | disclosed |
| WO-1997030687-A2 | FRAGRANCE PRECURSORS | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1997-08-28 | — | — | WO | disclosed |