⚠ 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 | |
|---|---|---|---|---|
| Acetic Acid Isobutyl Ester SCHEMBL1533352 | 0.97 | TSHR (0.56) | — | |
| Acetic Acid Isobutyl Ester SCHEMBL28592812 | 0.97 | — | — | |
| Acetic Acid Isobutyl Ester SCHEMBL21641877 | 0.97 | — | — | |
| Acetic Acid Isobutyl Ester SCHEMBL11120606 | 0.97 | — | — | |
| Acetic Acid Isobutyl Ester SCHEMBL8905422 | 0.97 | — | — | |
| Acetic Acid Isobutyl Ester SCHEMBL28806927 | 0.97 | — | — | |
| Acetic Acid Isobutyl Ester SCHEMBL18229923 | 0.97 | — | — | |
| Acetic Acid Isobutyl Ester SCHEMBL4591227 | 0.95 | TSHR (0.54) | — | |
| Acetic Acid Isobutyl Ester SCHEMBL1864546 | 0.95 | TSHR (0.54) | — | |
| Acetic Acid Isobutyl Ester SCHEMBL6360200 | 0.95 | TSHR (0.60) | — |
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
Appears in 59184 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20260146025-A1 | CRYSTALLINE POLYMORPHS OF MITAPIVAT AND MITAPIVAT HEMISULFATE | TIANISH LABORATORIES PRIVATE LIMITED (IN) | 2026-05-28 | — | — | US | claimed |
| US-20260146203-A1 | A PROCESS FOR PYROLYZING A POLYOLEFIN RECOVERED FROM A SOLID MATERIAL COMPRISING SAID POLYOLEFIN | BASF SE (DE) | 2026-05-28 | — | — | US | claimed |
| EP-4747238-A1 | PROCESS FOR PREPARING INTERMEDIATES OF SARTAN ACTIVE COMPOUNDS | Sanofi (FR) | 2026-05-27 | — | — | EP | claimed |
| CN-122080502-A | Furfuryl alcohol copolymer coated ammonium polyphosphate and application thereof in preparation of flame-retardant composite material | — | 2026-05-26 | — | — | CN | claimed |
| CN-122080292-A | Aqueous amide copolymer solution and preparation method and application thereof | — | 2026-05-26 | — | — | CN | claimed |
| CN-122079877-A | Industrial preparation method of 2-hydroxy-6- (trifluoromethyl) pyridine | — | 2026-05-26 | — | — | CN | claimed |
| CN-122095037-A | Coating composition | — | 2026-05-26 | — | — | CN | claimed |
| CN-122080054-A | Method for synthesizing tri (3, 4-methyl ethyl) phenol phosphate | — | 2026-05-26 | — | — | CN | claimed |
| CN-122080263-A | Preparation method of polyolefin material with low dissolution and low ash content | — | 2026-05-26 | — | — | CN | claimed |
| CN-122080293-A | Application of high para-isomer content methyl styrene mixture in preparation of polystyrene substituted copolymer | — | 2026-05-26 | — | — | CN | claimed |
| US-4010286-A | Flavoring with 4-methyl-1-oxaspiro[5.5]undecane | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-03-01 | — | — | US | claimed |
| US-4006028-A | LEAD OXIDE FRIT, REFRACTORY FILLER | OWENS-ILLINOIS, INC. (US) | 1977-02-01 | — | — | US | claimed |
| US-4000329-A | Flavoring compositions and foods containing one or more alkyl side chain methyl substituted or unsubstituted 2,2,6-trimethyl-1-cyclohexen-1-vinyl alkanoates | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1976-12-28 | — | — | US | claimed |
| US-4000327-A | BERRY FRUIT FOODSTUFFS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1976-12-28 | — | — | US | claimed |
| US-3967973-A | NITROCELLULOSE, SOLVENT, HYDROXYPROPYL CELLULOSE | OWENS-ILLINOIS, INC. (US) | 1976-07-06 | — | — | US | claimed |
| US-3960908-A | AQUEOUS EMULSIONS CONTAINING SILVER SALT, SALT OF CARBOXYLIC ACID AND SOLVENT | FUJI PHOTO FILM CO., LTD. (JA) | 1976-06-01 | — | — | US | claimed |
| US-3959508-A | Flavoring compositions containing mixture of 2,2,6-trimethyl-1-cyclohexen-1-ylacetaldehyde and 2,6,6-trimethyl-1-crotonyl-1,3-cyclohexadiene | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1976-05-25 | — | — | US | claimed |
| US-3956355-A | REACTING ACRYLONITRILE WITH A HYDROCARBON | SHOWA DENKO KABUSHIKI KAISHA (JA) | 1976-05-11 | — | — | US | claimed |
| US-3954397-A | LEWIS ACID DYE, 5 OR 6 MEMBERED HETEROCYCLIC TERTIARY AMINE | ROHM AND HAAS COMPANY (US) | 1976-05-04 | — | — | US | claimed |
| US-3940499-A | Food or flavor containing 2,6,6-trimethyl-1-cyclohexen-1-ylacetaldehyde | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1976-02-24 | — | — | US | claimed |