⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25102 | 0.98 | ATM (0.30) | — | |
| SCHEMBL18899114 | 0.98 | ATM (0.30) | — | |
| SCHEMBL18372673 | 0.93 | ATM (0.30) | — | |
| SCHEMBL26052834 | 0.93 | ATM (0.30) | — | |
| SCHEMBL26050137 | 0.93 | ATM (0.30) | — | |
| SCHEMBL24571795 | 0.89 | — | — | |
| SCHEMBL21185111 | 0.89 | — | — | |
| SCHEMBL18576891 | 0.85 | CYP1A2 (0.35) | — | |
| SCHEMBL18576605 | 0.85 | CYP1A2 (0.35) | — | |
| SCHEMBL18573248 | 0.85 | CYP1A2 (0.35) | — |
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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4010286-A | Flavoring with 4-methyl-1-oxaspiro[5.5]undecane | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-03-01 | — | — | US | claimed |
| US-11334694-B2 | Personal care compositions comprising malodor reduction compositions | THE PROCTER & GAMBLE COMPANY (US) | 2022-05-17 | — | — | US | disclosed |
| US-11334695-B2 | Antiperspirant and deodorant compositions comprising malodor reduction compositions | THE PROCTER & GAMBLE COMPANY (US) | 2022-05-17 | — | — | US | disclosed |
| WO-2021043209-A1 | RET INHIBITOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF | 广东东阳光药业有限公司 | 2021-03-11 | — | — | WO | disclosed |
| EP-3610874-A1 | PHARMACEUTICAL COMPOSITION CONTAINING MOR AGONIST AND KOR AGONIST, AND USES THEREOF | Jiangsu Hengrui Medicine Co., Ltd. (CN) | 2020-02-19 | — | — | EP | disclosed |
| US-9845443-B2 | Synthesis of a novel odorant | VAZE KEDAR RAMESH (IN) | 2017-12-19 | — | — | US | disclosed |
| US-9845443-B2 | Synthesis of a novel odorant | VAZE KEDAR RAMESH (IN) | 2017-12-19 | — | — | US | disclosed |
| US-9845443-B2 | Synthesis of a novel odorant | VAZE KEDAR RAMESH (IN) | 2017-12-19 | — | — | US | disclosed |
| EP-2609184-B1 | PERFUMERY COMPOSITIONS AND SYNTHESIS OF A ODORANT | VAZE KEDAR RAMESH (IN) | 2017-02-15 | — | — | EP | disclosed |
| EP-2609184-B1 | PERFUMERY COMPOSITIONS AND SYNTHESIS OF A ODORANT | VAZE KEDAR RAMESH (IN) | 2017-02-15 | — | — | EP | disclosed |
| US-20130157923-A1 | SYNTHESIS OF A NOVEL ODORANT | VAZE KEDAR RAMESH (IN) | 2013-06-20 | — | — | US | disclosed |
| US-20130157923-A1 | SYNTHESIS OF A NOVEL ODORANT | VAZE KEDAR RAMESH (IN) | 2013-06-20 | — | — | US | disclosed |
| WO-2012025934-A1 | SYNTHESIS OF A NOVEL ODORANT | VAZE KEDAR RAMESH (IN) | 2012-03-01 | — | — | WO | disclosed |
| WO-2012025934-A1 | SYNTHESIS OF A NOVEL ODORANT | VAZE KEDAR RAMESH (IN) | 2012-03-01 | — | — | WO | disclosed |
| US-4240447-A | ENHANCING AROMA AND TASTE | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1980-12-23 | — | — | US | disclosed |
| US-4192782-A | Use of certain spiropyran derivatives for augmenting, enhancing or modifying the organoleptic properties of perfumes and colognes | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1980-03-11 | — | — | US | disclosed |
| US-4186103-A | Use of spiropyran derivatives in augmenting, enhancing or modifying the aroma of detergents | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1980-01-29 | — | — | US | disclosed |
| US-4010286-A | Flavoring with 4-methyl-1-oxaspiro[5.5]undecane | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-03-01 | — | — | US | disclosed |
| US-4010286-A | Flavoring with 4-methyl-1-oxaspiro[5.5]undecane | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-03-01 | — | — | US | disclosed |
| US-4010286-A | Flavoring with 4-methyl-1-oxaspiro[5.5]undecane | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-03-01 | — | — | US | disclosed |