⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9656868 | 0.88 | — | — | |
| SCHEMBL18316479 | 0.88 | — | — | |
| SCHEMBL238099 | 0.88 | — | — | |
| SCHEMBL16995921 | 0.88 | — | — | |
| SCHEMBL9657891 | 0.88 | — | — | |
| SCHEMBL23483313 | 0.88 | — | — | |
| SCHEMBL22141051 | 0.86 | — | — | |
| SCHEMBL5049182 | 0.84 | — | — | |
| SCHEMBL313294 | 0.83 | ADRB2 (0.32) | — | |
| SCHEMBL11301888 | 0.82 | CHRNB2 (0.34) | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9157048-B2 | Perfume | SYMRISE AG (DE) | 2015-10-13 | — | — | US | claimed |
| US-20130261036-A1 | PERFUME | SYMRISE AG (DE) | 2013-10-03 | — | — | US | claimed |
| EP-2632554-A1 | PERFUME | Symrise AG (DE) | 2013-09-04 | — | — | EP | claimed |
| WO-2012055875-A1 | PERFUME | SYMRISE AG (DE) | 2012-05-03 | — | — | WO | claimed |
| EP-2632554-B1 | PERFUME | SYMRISE AG (DE) | 2017-01-04 | — | — | EP | disclosed |
| EP-2632554-B1 | PERFUME | SYMRISE AG (DE) | 2017-01-04 | — | — | EP | disclosed |
| US-9157048-B2 | Perfume | SYMRISE AG (DE) | 2015-10-13 | — | — | US | disclosed |
| US-9157048-B2 | Perfume | SYMRISE AG (DE) | 2015-10-13 | — | — | US | disclosed |
| US-9157048-B2 | Perfume | SYMRISE AG (DE) | 2015-10-13 | — | — | US | disclosed |
| US-20130261036-A1 | PERFUME | SYMRISE AG (DE) | 2013-10-03 | — | — | US | disclosed |
| US-20130261036-A1 | PERFUME | SYMRISE AG (DE) | 2013-10-03 | — | — | US | disclosed |
| US-20130261036-A1 | PERFUME | SYMRISE AG (DE) | 2013-10-03 | — | — | US | disclosed |
| EP-2632554-A1 | PERFUME | Symrise AG (DE) | 2013-09-04 | — | — | EP | disclosed |
| WO-2012055875-A1 | PERFUME | SYMRISE AG (DE) | 2012-05-03 | — | — | WO | disclosed |
| WO-2012055875-A1 | PERFUME | SYMRISE AG (DE) | 2012-05-03 | — | — | WO | disclosed |