⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1931496 | 1.00 | — | — | |
| SCHEMBL10611186 | 0.81 | ALDH1A1 (0.58) | — | |
| SCHEMBL691908 | 0.77 | TSHR (0.52) | — | |
| SCHEMBL7177698 | 0.77 | CA2 (0.62) | — | |
| SCHEMBL18197 | 0.77 | CA2 (0.62) | — | |
| SCHEMBL29446988 | 0.77 | CA2 (0.62) | — | |
| SCHEMBL8429914 | 0.74 | — | — | |
| Ammonia Solution, Strong SCHEMBL28322857 | 0.74 | CA2 (0.59) | — | |
| SCHEMBL7806601 | 0.74 | CA2 (0.59) | — | |
| Phosphine SCHEMBL28067413 | 0.74 | CA2 (0.59) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-12122994-B2 | Methods for fermentative production of massoia lactone | TEMASEK LIFE SCIENCES LABORATORY LIMITED (SG) | 2024-10-22 | — | — | US | disclosed |
| US-20230365915-A1 | METHODS FOR FERMENTATIVE PRODUCTION OF MASSOIA LACTONE | TEMASEK LIFE SCIENCES LABORATORY LIMITED (SG) | 2023-11-16 | — | — | US | disclosed |
| US-11639492-B2 | Methods for fermentative production of massoia lactone | TEMASEK LIFE SCIENCES LABORATORY LIMITED (SG) | 2023-05-02 | — | — | US | disclosed |
| EP-3337889-B1 | METHODS FOR FERMENTATIVE PRODUCTION OF MASSOIA LACTONE | TEMASEK LIFE SCIENCES LABORATORY LTD (SG) | 2023-04-26 | — | — | EP | disclosed |
| US-20220372451-A1 | PRODUCTION OF PYRUVATE OR PRODUCTS DERIVED FROM PYRUVATE USING MODIFIED ESCHERICHIA COLI | NATIONAL SCIENCE FOUNDATION | 2022-11-24 | — | — | US | disclosed |