⚠ 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 | |
|---|---|---|---|---|
| Propionic Acid SCHEMBL570852 | 0.96 | FFAR3 (0.91) | — | |
| Propionic Acid SCHEMBL28074375 | 0.96 | — | — | |
| Propionic Acid SCHEMBL240640 | 0.96 | — | — | |
| Propionic Acid SCHEMBL148208 | 0.96 | — | — | |
| Propionic Acid SCHEMBL8037206 | 0.96 | — | — | |
| Propionic Acid SCHEMBL28332578 | 0.92 | — | — | |
| Propionic Acid SCHEMBL28172375 | 0.92 | — | — | |
| Propionic Acid SCHEMBL28594616 | 0.92 | — | — | |
| Propionic Acid SCHEMBL28959623 | 0.92 | — | — | |
| Propionic Acid SCHEMBL27822982 | 0.92 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6391598-B1 | GENERATING PREFERENTIAL FATTY ACID COMPOUNDS; OBTAIN ANIMAL RUMINAL FLUID, INCUBATE WITH METAL OXIDE, RECOVER PREFERENTIAL FATTY ACID COMPOUND | BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA | 2002-05-21 | — | — | US | claimed |