⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16634380 | 1.00 | — | — | |
| SCHEMBL16634379 | 1.00 | — | — | |
| SCHEMBL21889566 | 0.76 | — | — | |
| SCHEMBL15435620 | 0.73 | ALOX15 (0.33) | — | |
| SCHEMBL2270266 | 0.70 | — | — | |
| SCHEMBL24736503 | 0.70 | MET (0.31) | — | |
| SCHEMBL25204886 | 0.69 | — | — | |
| SCHEMBL4978490 | 0.68 | MET (0.44) | — | |
| SCHEMBL21089697 | 0.68 | MET (0.33) | — | |
| SCHEMBL28617736 | 0.68 | MET (0.44) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3005884-B1 | TASTE MODULATOR AND METHOD OF USE THEREOF | INT FLAVORS & FRAGRANCES INC (US) | 2017-04-19 | — | — | EP | disclosed |
| EP-3005884-A1 | TASTE MODULATOR AND METHOD OF USE THEREOF | International Flavors & Fragrances Inc. (US) | 2016-04-13 | — | — | EP | disclosed |
| US-20150104398-A1 | TASTE MODULATOR AND METHOD OF USE THEREOF | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2015-04-16 | — | — | US | disclosed |