⚠ 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 | |
|---|---|---|---|---|
| Levulinic Acid SCHEMBL113572 | 0.97 | LMNA (1.00) | — | |
| Levulinic Acid SCHEMBL20868 | 0.97 | — | — | |
| Levulinic Acid SCHEMBL27931545 | 0.97 | LMNA (1.00) | — | |
| Levulinic Acid SCHEMBL30530258 | 0.97 | — | — | |
| Levulinic Acid SCHEMBL12971398 | 0.93 | — | — | |
| Levulinic Acid SCHEMBL21815654 | 0.93 | — | — | |
| Levulinic Acid SCHEMBL439420 | 0.93 | — | — | |
| Levulinic Acid SCHEMBL21815732 | 0.93 | — | — | |
| Levulinic Acid SCHEMBL21815797 | 0.93 | — | — | |
| Levulinic Acid SCHEMBL10835733 | 0.93 | — | — |
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-5022045-A | Optical-type, phase transition humidity-responsive devices | ELLIOTT STANLEY B (US) | 1991-06-04 | — | — | US | claimed |