⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1502170 | 0.74 | — | — | |
| SCHEMBL125458 | 0.72 | — | — | |
| SCHEMBL124557 | 0.67 | — | — | |
| SCHEMBL27905716 | 0.67 | TLR4 (0.33) | — | |
| SCHEMBL27398164 | 0.67 | — | — | |
| SCHEMBL11813392 | 0.65 | ALDH1A1 (0.36) | — | |
| SCHEMBL14362697 | 0.63 | — | — | |
| SCHEMBL124901 | 0.63 | — | — | |
| SCHEMBL6534885 | 0.63 | — | — | |
| SCHEMBL8519835 | 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-119655329-A | Method for preparing flavoring oil and/or fat | 丰益国际有限公司 | 2025-03-21 | — | — | CN | claimed |
| CN-116165293-A | Method for evaluating characteristic flavor of red date slices based on human-computer interaction | 中华全国供销合作总社济南果品研究所 | 2023-05-26 | — | — | CN | disclosed |
| US-8709502-B2 | Extract of Vanilla planifolia | CHANEL PARFUMS BEAUTE (FR) | 2014-04-29 | — | — | US | disclosed |
| US-20120059163-A1 | Non-linear opticaly active molecules, their synthesis, and use | OPTIMER PHOTONICS, INC. (US) | 2012-03-08 | — | — | US | disclosed |
| US-20120059163-A1 | Non-linear opticaly active molecules, their synthesis, and use | OPTIMER PHOTONICS, INC. (US) | 2012-03-08 | — | — | US | disclosed |
| US-20080004415-A1 | Non-linear optically active molecules, their synthesis, and use | OPTIMER PHOTONICS, INC. (US) | 2008-01-03 | — | — | US | disclosed |
| US-20080004415-A1 | Non-linear optically active molecules, their synthesis, and use | OPTIMER PHOTONICS, INC. (US) | 2008-01-03 | — | — | US | disclosed |
| US-20070071710-A1 | EXTRACT OF VANILLA PLANIFOLIA | CHANEL PARFUMS BEAUTE (FR) | 2007-03-29 | — | — | US | disclosed |