⚠ 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 | |
|---|---|---|---|---|
| Hexane SCHEMBL9557662 | 1.00 | TSHR (0.88) | — | |
| Hexane SCHEMBL8705498 | 1.00 | TSHR (0.88) | — | |
| Hexane SCHEMBL357364 | 1.00 | TSHR (0.88) | — | |
| Hexane SCHEMBL5017645 | 1.00 | TSHR (0.88) | — | |
| Hexane SCHEMBL11650566 | 1.00 | TSHR (0.88) | — | |
| Hexane SCHEMBL8151140 | 1.00 | TSHR (0.88) | — | |
| Hexane SCHEMBL9859565 | 1.00 | TSHR (0.88) | — | |
| Tetradecane SCHEMBL25387874 | 0.94 | TSHR (1.00) | — | |
| Decane SCHEMBL23499900 | 0.94 | TSHR (1.00) | — | |
| Hexane SCHEMBL23175213 | 0.94 | — | — |
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 1469499 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-9975101-B2 | Process for preparation of self healing microcapsules | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2018-05-22 | — | — | US | claimed |
| US-9974750-B1 | Synthesis of ifflaionic acid nanoparticles | KING SAUD UNIVERSITY (SA) | 2018-05-22 | — | — | US | claimed |
| US-9975178-B2 | Cross-phase separation of nanowires and nanoparticles | LAWRENCE LIVERMORE NATIONAL SECURITY, LLC (US) | 2018-05-22 | — | — | US | claimed |
| US-9974859-B2 | Nanostructured gels capable of controlled release of entrapped agents | THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) | 2018-05-22 | — | — | US | claimed |
| US-20180134730-A1 | IMPROVED PROCESS FOR PREPARING BORYL 7-AZAINDOLE COMPOUNDS | BOROPHARM INC (US) | 2018-05-17 | — | — | US | claimed |
| US-20180134731-A1 | PROCESS TO PREPARE ALUMINOXANES | NOURYON CHEMICALS INTERNATIONAL B.V. (NL) | 2018-05-17 | — | — | US | claimed |
| US-20180134736-A1 | Luminescent Metal Halide Perovskites and Methods | FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. | 2018-05-17 | — | — | US | claimed |
| WO-2018089325-A1 | COMPOSITION CONTAINING OROXYLIN A AND METHOD OF EXTRACTION THEREOF | MAJEED MUHAMMED (US) | 2018-05-17 | — | — | WO | claimed |
| US-20180134738-A1 | DISUBSTITUTED ALKYNE DICOBALT HEXACARBONYL COMPOUNDS, METHOD OF MAKING AND METHOD OF USE THEREOF | VERSUM MATERIALS US, LLC (US) | 2018-05-17 | — | — | US | claimed |
| US-20180134678-A1 | PROCESS FOR ISOLATING AND PURIFYING AMBROX | GIVAUDAN SA (CH) | 2018-05-17 | — | — | US | claimed |
| US-3950514-A | Antibiotic TM-481 derived from microorganism of the streptomyces ribosidificus group | TAISHO PHARMACEUTICAL CO., LTD. (JA) | 1976-04-13 | — | — | US | claimed |
| US-3949008-A | Purification of crude dinitrotoluene by extraction with C5 -C8 alkanes | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1976-04-06 | — | — | US | claimed |
| US-3948868-A | ISOOLEFIN COPOLYMERS | EXXON RESEARCH AND ENGINEERING COMPANY (US) | 1976-04-06 | — | — | US | claimed |
| US-3946054-A | PERFUMES, TOBACCO, FOOD FLAVORS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1976-03-23 | — | — | US | claimed |
| US-3946088-A | ALUMINUM CHLORIDE OR BROMIDE CATALYST, HYDROGEN CHLORIDE OR BROMIDE SOLVENT | EXXON RESEARCH & ENGINEERING CO. (US) | 1976-03-23 | — | — | US | claimed |
| US-3943066-A | Preparation of composition for making hydrocarbon and fats into biodegradable emulsions | BANQUE POUR L'EXPANSION INDUSTRIELLE "BANEXI" (FR) | 1976-03-09 | — | — | US | claimed |
| US-3940548-A | Surface treatment of rubber articles with an alkyl hypohalite | NIPPON ZLIN CO. LTD. (JA) | 1976-02-24 | — | — | US | claimed |
| US-3933764-A | TREATMENT WITH ALIPHATIC HYDROCARBON | UNION CARBIDE CORPORATION (US) | 1976-01-20 | — | — | US | claimed |
| US-3932475-A | OXIDATION OF A HALOGENATED TRIMETHYLPHENOL | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1976-01-13 | — | — | US | claimed |
| US-3932386-A | Sodium 6-(L-aminocyclohexane carboxamido)penicillanic acid | AMERICAN HOME PRODUCTS CORPORATION (US) | 1976-01-13 | — | — | US | claimed |