⚠ 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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL4406446 | 0.78 | — | — | |
| Ethylene Glycol SCHEMBL3697586 | 0.78 | TSHR (0.62) | — | |
| Ethylene Glycol SCHEMBL8734037 | 0.78 | TSHR (0.62) | — | |
| SCHEMBL20715 | 0.78 | — | — | |
| SCHEMBL10939943 | 0.72 | — | — | |
| Ammonia Solution, Strong SCHEMBL29186442 | 0.72 | — | — | |
| Ammonia Solution, Strong SCHEMBL29186441 | 0.72 | — | — | |
| Ethylene Glycol SCHEMBL8013339 | 0.71 | TSHR (1.00) | — | |
| Ethylene Glycol SCHEMBL3 | 0.71 | — | — | |
| Ethylene Glycol SCHEMBL49878 | 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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0357048-B1 | Process for transhalogenating a halophosphorus compound with hydrogen fluoride | ALBEMARLE CORP (US) | 1994-09-28 | — | — | EP | disclosed |
| EP-0358985-B1 | Method of transhalogenating a halophosphorus compound with fluoride | ETHYL CORP (US) | 1994-03-16 | — | — | EP | disclosed |
| EP-0312790-B1 | Process for transhalogenating a halophosphorus compound with fluoride | ETHYL CORP (US) | 1993-11-18 | — | — | EP | disclosed |
| US-5136075-A | Process for transhalogenating a halophosphorus compound with fluoride | ETHYL CORPORATION (US) | 1992-08-04 | — | — | US | disclosed |
| US-5061818-A | Fluorination with metal or ammonium fluoride in presence of pyridine halide salt | ETHYL CORPORATION (US) | 1991-10-29 | — | — | US | disclosed |
| US-5049691-A | Process for transhalogenating a halophosphorous compound with anhydrous hydrogen fluoride | ETHYL CORPORATION (US) | 1991-09-17 | — | — | US | disclosed |
| US-4929745-A | Transhalogenation of halophosphorus compounds | EHTYL CORPORATION (US) | 1990-05-29 | — | — | US | disclosed |
| EP-0358985-A1 | Method of transhalogenating a halophosphorus compound with fluoride | ETHYL CORPORATION (US) | 1990-03-21 | — | — | EP | disclosed |
| US-4910324-A | Using a metal or ammonium fluoride | ETHYL CORPORATION (US) | 1990-03-20 | — | — | US | disclosed |
| EP-0357048-A2 | Process for transhalogenating a halophosphorus compound with hydrogen fluoride | ALBEMARLE CORPORATION (US) | 1990-03-07 | — | — | EP | disclosed |
| EP-0353598-A2 | Transhalogenation of halophosphorus compounds | ETHYL CORPORATION (US) | 1990-02-07 | — | — | EP | disclosed |
| EP-0312790-A2 | Process for transhalogenating a halophosphorus compound with fluoride | ETHYL CORPORATION (US) | 1989-04-26 | — | — | EP | disclosed |
| US-4767851-A | Process for the preparation of 7-amino and 7-substituted amino-desacetoxycephalosporins | GEMA, S.A. (ES) | 1988-08-30 | — | — | US | disclosed |
| EP-0169144-A2 | Process for the preparation of 7-amino and 7-substituted amino-desacetoxycephalosporins from the corresponding 6-substituted amino penicillin sulphoxides | GEMA S.A. (ES) | 1986-01-22 | — | — | EP | disclosed |