⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL504537 | 0.73 | — | — | |
| SCHEMBL7191657 | 0.67 | — | — | |
| SCHEMBL504586 | 0.65 | — | — | |
| SCHEMBL9942382 | 0.65 | — | — | |
| SCHEMBL28381170 | 0.65 | — | — | |
| SCHEMBL27770456 | 0.64 | — | — | |
| SCHEMBL23555162 | 0.63 | TSHR (0.33) | — | |
| Fluoride SCHEMBL1264751 | 0.62 | TSHR (0.40) | — | |
| Fluoride SCHEMBL635869 | 0.62 | TSHR (0.40) | — | |
| SCHEMBL28573462 | 0.62 | ALDH1A1 (0.32) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2651910-B1 | PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES | ARCHER-DANIELS-MIDLAND COMPANY (US) | 2016-12-07 | — | — | EP | disclosed |
| EP-2752408-B1 | Preparation of aminomethyl furans and alkoxymethyl furan derivatives from carbohydrates | ARCHER DANIELS MIDLAND CO (US) | 2016-05-18 | — | — | EP | disclosed |
| US-8901326-B2 | Preparation of aminomethyl furans and alkoxymethyl furan derivatives from carbohydrates | ARCHER DANIELS MIDLAND COMPANY (US) | 2014-12-02 | — | — | US | disclosed |
| EP-2752408-A1 | Preparation of aminomethyl furans and alkoxymethyl furan derivatives from carbohydrates | Archer-Daniels-Midland Company (US) | 2014-07-09 | — | — | EP | disclosed |
| US-20140148605-A1 | PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES | ARCHER DANIELS MIDLAND COMPANY (US) | 2014-05-29 | — | — | US | disclosed |
| US-8669383-B2 | Preparation of aminomethyl furans and alkoxymethyl furan derivatives from carbohydrates | ARCHER DANIELS MIDLAND COMPANY (US) | 2014-03-11 | — | — | US | disclosed |
| US-20130303791-A1 | PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES | ARCHER DANIELS MIDLAND COMPANY (US) | 2013-11-14 | — | — | US | disclosed |
| EP-2651910-A1 | PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES | Archer-Daniels-Midland Company (US) | 2013-10-23 | — | — | EP | disclosed |
| WO-2012082665-A1 | PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES | ARCHER DANIELS MIDLAND COMPANY (US) | 2012-06-21 | — | — | WO | disclosed |