⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL555929 | 0.79 | — | — | |
| SCHEMBL9651374 | 0.78 | TSHR (0.41) | — | |
| SCHEMBL15050449 | 0.76 | THRB (0.40) | — | |
| SCHEMBL555910 | 0.75 | — | — | |
| SCHEMBL23647967 | 0.74 | — | — | |
| SCHEMBL271779 | 0.74 | THRB (0.38) | — | |
| SCHEMBL2857837 | 0.73 | THRB (0.33) | — | |
| SCHEMBL28662298 | 0.73 | TSHR (0.40) | — | |
| SCHEMBL3972048 | 0.72 | — | — | |
| SCHEMBL7321254 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114695957-A | Preparation method and application of novel electrolyte additive containing fluorine, boron and phosphorus | 浙江省化工研究院有限公司 | 2022-07-01 | — | — | CN | claimed |
| US-6197867-B1 | DINITRILE PROCESSING AIDS | THE GOODYEAR TIRE & RUBBER COMPANY | 2001-03-06 | — | — | US | claimed |
| CN-114695957-A | Preparation method and application of novel electrolyte additive containing fluorine, boron and phosphorus | 浙江省化工研究院有限公司 | 2022-07-01 | — | — | CN | disclosed |
| EP-1583606-A1 | PROCESS FOR PRODUCTION OF HIGH OCTANE GASOLINE FROM STRAIGHT RUN LIGHT NAPHTHA ON Pt CONTAINING HZSM - 5 MOLECULAR SIEVE CATALYST | Council of Scientific and Industrial Research (IN) | 2005-10-12 | — | — | EP | disclosed |
| US-20040182748-A1 | Process for production of high octane gasoline from straight run light naphtha on Pt containing HZSM - 5 molecular sieve catalyst | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH | 2004-09-23 | — | — | US | disclosed |
| WO-2004058400-A1 | PROCESS FOR PRODUCTION OF HIGH OCTANE GASOLINE FROM STRAIGHT RUN LIGHT NAPHTHA ON Pt CONTAINING HZSM - 5 MOLECULAR SIEVE CATALYST | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2004-07-15 | — | — | WO | disclosed |
| US-6197867-B1 | DINITRILE PROCESSING AIDS | THE GOODYEAR TIRE & RUBBER COMPANY | 2001-03-06 | — | — | US | disclosed |
| EP-0965613-A1 | Rubber compositions containing organo-nitriles | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1999-12-22 | — | — | EP | disclosed |