⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4830509 | 0.76 | PKM (0.32) | — | |
| SCHEMBL12440749 | 0.74 | MAPT (0.37) | — | |
| SCHEMBL5918165 | 0.73 | ALDH1A1 (0.40) | — | |
| SCHEMBL21447593 | 0.69 | PLAU (0.47) | — | |
| SCHEMBL1584140 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL14941077 | 0.64 | — | — | |
| SCHEMBL910894 | 0.63 | — | — | |
| SCHEMBL1765140 | 0.62 | SLC22A1 (0.31) | — | |
| SCHEMBL9158794 | 0.62 | APLNR (0.33) | — | |
| SCHEMBL17243999 | 0.62 | — | — |
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-106459668-A | Fast curing migration-free compositions based on organic polymers containing silane groups | SIKA技术股份公司 | 2017-02-22 | — | — | CN | claimed |
| CN-105452336-B | It is continuous prepare polyamide oligomer and prepare can thermoplastic processing hypocrystalline or amorphous polyamides method | 巴斯夫欧洲公司 | 2018-10-23 | — | — | CN | disclosed |
| EP-1137745-A1 | FUEL ADDITIVE AND FUEL COMPOSITION CONTAINING THE SAME | Infineum Holdings BV (NL) | 2001-10-04 | — | — | EP | disclosed |
| WO-2000042133-A1 | IMPROVED FUEL COMPOSITIONS | INFINEUM INTERNATIONAL LTD (GB) | 2000-07-20 | — | — | WO | disclosed |
| WO-2000034418-A1 | FUEL ADDITIVE AND FUEL COMPOSITION CONTAINING THE SAME | INFINEUM HOLDINGS B.V. (NL) | 2000-06-15 | — | — | WO | disclosed |
| EP-0897382-A1 | ALKOXY ACETIC ACID DERIVATIVES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1999-02-24 | — | — | EP | disclosed |
| US-5855629-A | FUEL ADDITIVE | SHELL OIL COMPANY (US) | 1999-01-05 | — | — | US | disclosed |
| WO-1997041092-A1 | ALKOXY ACETIC ACID DERIVATIVES | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1997-11-06 | — | — | WO | disclosed |