⚠ 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 | |
|---|---|---|---|---|
| Isobutane SCHEMBL9578989 | 1.00 | ALDH1A1 (0.36) | — | |
| Isobutane SCHEMBL9301743 | 0.95 | TSHR (0.33) | — | |
| SCHEMBL28093268 | 0.88 | — | — | |
| SCHEMBL27576842 | 0.84 | — | — | |
| Isopropyl Alcohol SCHEMBL11144129 | 0.84 | — | — | |
| Isobutane SCHEMBL27668226 | 0.83 | TSHR (0.35) | — | |
| SCHEMBL437564 | 0.82 | — | — | |
| SCHEMBL10871026 | 0.82 | ALDH1A1 (0.46) | — | |
| SCHEMBL434958 | 0.82 | — | — | |
| SCHEMBL6799285 | 0.82 | ALDH1A1 (0.46) | — |
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 96 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105884567-A | Method for extracting isobutane, isobutene and hydrogen rich gas from chemical tail gas | 朱琳 | 2016-08-24 | — | — | CN | claimed |
| EP-2236484-A1 | PLANT FOR THE LIQUID PHASE SYNTHESIS OF ISOPRENE FROM ISOBUTYLENE AND FORMALDEHYDE | Obshestvo O Ogranichennoi Otvetstvennoctiu "Eurochim SPB-Treiding" (RU) | 2010-10-06 | — | — | EP | claimed |
| WO-2007118870-A2 | METHOD FOR THE PRODUCTION OF OLEFINS, ALDEHYDES, AND CARBOXYLIC ACIDS BY OXIDATION OF ALKANES | LEIBNIZ-INSTITUT FÜR KATALYSE E.V. AN DER UNIVERSITÄT ROSTOCK (DE) | 2007-10-25 | — | — | WO | claimed |
| WO-2024107604-A1 | NAPHTHA TO ETHANE AND PROPANE UNIT WITH HYDROGEN SLIP | UOP LLC (US) | 2024-05-23 | — | — | WO | disclosed |
| US-20240158320-A1 | NAPHTHA TO ETHANE AND PROPANE UNIT WITH HYDROGEN SLIP | UOP LLC | 2024-05-16 | — | — | US | disclosed |
| CN-112585108-B | Method for producing high-purity isobutene | 鲁姆斯科技有限责任公司 | 2024-03-08 | — | — | CN | disclosed |
| WO-2023244596-A1 | PROCESS FOR CATALYTICALLY CONVERTING NAPHTHA TO LIGHT OLEFINS WITH PREDOMINANT MODES | UOP LLC (US) | 2023-12-21 | — | — | WO | disclosed |
| US-20230399274-A1 | PROCESS FOR CATALYTICALLY CONVERTING NAPHTHA TO LIGHT OLEFINS WITH PREDOMINANT MODES | UOP LLC (US) | 2023-12-14 | — | — | US | disclosed |
| WO-2023219849-A1 | PROCESS FOR CONVERTING NAPHTHA TO LIGHT OLEFINS WITH SEPARATION | UOP LLC (US) | 2023-11-16 | — | — | WO | disclosed |
| WO-2023219868-A1 | PROCESS FOR CATALYTICALLY CONVERTING NAPHTHA TO LIGHT OLEFINS | UOP LLC (US) | 2023-11-16 | — | — | WO | disclosed |
| US-20230357654-A1 | PROCESS FOR CONVERTING NAPHTHA TO LIGHT OLEFINS WITH SEPARATION | UOP LLC | 2023-11-09 | — | — | US | disclosed |
| WO-1991016283-A1 | ENVIRONMENTALLY SAFE CATALYTIC ALKYLATION USING LIQUID ONIUM POLY (HYDROGEN FLUORIDES) | OLAH GEORGE A (US) | 1991-10-31 | — | — | WO | disclosed |
| EP-0205562-B1 | PROCESS FOR PREPARING ETHERS | UNION CARBIDE CORPORATION (US) | 1988-11-23 | — | — | EP | disclosed |
| US-4740631-A | Process for preparing ethers | UNION CARBIDE CORPORATION (US) | 1988-04-26 | — | — | US | disclosed |
| US-4663493-A | HEAT OF REACTION | UOP INC. (US) | 1987-05-05 | — | — | US | disclosed |
| EP-0205562-A1 | PROCESS FOR PREPARING ETHERS. | UNION CARBIDE CORP (US) | 1986-12-30 | — | — | EP | disclosed |
| WO-1986003484-A1 | PROCESS FOR PREPARING ETHERS | UNION CARBIDE CORPORATION (US) | 1986-06-19 | — | — | WO | disclosed |
| EP-0125769-A2 | Supported catalysts | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1984-11-21 | — | — | EP | disclosed |
| US-4017518-A | FROM ISOBUTYLENE AND FORMALDEHYDE, CATALYTIC | GORBUNOV BORIS NIKOLAEVICH | 1977-04-12 | — | — | US | disclosed |
| US-4012456-A | Method for separation of isobutylene from C4 hydrocarbon fractions | CHAPLITS DONAT N | 1977-03-15 | — | — | US | disclosed |