⚠ 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 | |
|---|---|---|---|---|
| Acetone SCHEMBL8627759 | 0.80 | — | — | |
| Acetone SCHEMBL28884130 | 0.80 | — | — | |
| Acetic Acid SCHEMBL27092990 | 0.78 | — | — | |
| Acetic Acid SCHEMBL160532 | 0.75 | — | — | |
| Acetone SCHEMBL28155459 | 0.75 | — | — | |
| SCHEMBL5488 | 0.75 | — | — | |
| SCHEMBL10598372 | 0.75 | — | — | |
| Acetone SCHEMBL5665105 | 0.72 | LMNA (1.00) | — | |
| Acetone SCHEMBL528137 | 0.72 | LMNA (1.00) | — | |
| Acetone SCHEMBL10051943 | 0.72 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6329151-B1 | SEPARATING MICROBIAL CELLS INTO TWO POPULATIONS; EXPOSING ONE GROUP TO A STIMULANT, THEN EXTRACT AND AMPLIFY RNA FROM BOTH GROUPS OF CELLS USING 32 DIFFERENT PRIMERS FROM THE COMMON AND VARIABLE REGIONS, IDENTIFY DIFFERENTIALLY EXPRESSED GENES | E. I. DU PONT DE NEMOURS AND COMPANY | 2001-12-11 | — | — | US | disclosed |
| EP-1153141-A2 | HIGH DENSITY SAMPLING OF DIFFERENTIALLY EXPRESSED PROKARYOTIC mRNA | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2001-11-14 | — | — | EP | disclosed |
| WO-2000049177-A2 | HIGH DENSITY SAMPLING OF DIFFERENTIALLY EXPRESSED PROKARYOTIC mRNA | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2000-08-24 | — | — | WO | disclosed |