⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11266654 | 0.94 | — | — | |
| SCHEMBL1134720 | 0.88 | — | — | |
| Hexamethylbenzene SCHEMBL114857 | 0.79 | RXFP1 (0.33) | — | |
| SCHEMBL13909010 | 0.76 | — | — | |
| SCHEMBL15362870 | 0.76 | — | — | |
| SCHEMBL19072787 | 0.76 | — | — | |
| SCHEMBL11976521 | 0.76 | — | — | |
| SCHEMBL12621112 | 0.76 | — | — | |
| Hexamethylbenzene SCHEMBL10608743 | 0.72 | RXFP1 (0.31) | — | |
| Hexamethylbenzene SCHEMBL10952629 | 0.72 | RXFP1 (0.31) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0130368-A1 | Conversion of methanol to hydrocarbons | UNION CARBIDE CORPORATION (US) | 1985-01-09 | — | — | EP | claimed |
| US-20230166635-A1 | MONITORING HEALTH OF HEAT TRANSFER FLUIDS FOR ELECTRIC SYSTEMS | ExxonMobil Technology and Engineering Company (US) | 2023-06-01 | — | — | US | disclosed |
| WO-2023033035-A1 | CARBON DIOXIDE CAPTURING AGENT, METAL-ORGANIC FRAMEWORK, AND COMPOUND | ＥＮＥＯＳ株式会社 | 2023-03-09 | — | — | WO | disclosed |
| CN-113185396-B | Biphenyl decaformic acid, preparation method of biphenyl decamethyl decaformate and analysis method of biphenyl decamethyl decaformate | 枣庄学院 | 2022-09-13 | — | — | CN | disclosed |
| CN-113185396-A | Biphenyl decaformic acid, preparation method of biphenyl decamethyl decaformate and analysis method of biphenyl decamethyl decaformate | 枣庄学院 | 2021-07-30 | — | — | CN | disclosed |
| US-20210040369-A1 | Heat Transfer Fluids and Methods of Use | EXXONMOBIL RES & ENG CO (US) | 2021-02-11 | — | — | US | disclosed |
| US-5026917-A | Acetylation of 2-methylnaphthalenes | AMOCO CORPORATION (US) | 1991-06-25 | — | — | US | disclosed |
| EP-0130368-A1 | Conversion of methanol to hydrocarbons | UNION CARBIDE CORPORATION (US) | 1985-01-09 | — | — | EP | disclosed |