⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28321950 | 0.61 | LMNA (0.35) | — | |
| SCHEMBL27526219 | 0.57 | — | — | |
| SCHEMBL5506074 | 0.56 | KDM4E (0.36) | — | |
| SCHEMBL27941144 | 0.53 | — | — | |
| SCHEMBL15331807 | 0.52 | — | — | |
| SCHEMBL13990267 | 0.52 | CSNK2A2 (0.47) | — | |
| SCHEMBL13811309 | 0.50 | NPC1 (0.59) | — | |
| SCHEMBL13990266 | 0.50 | GABRP (0.47) | — | |
| SCHEMBL12553330 | 0.50 | APP (0.47) | — | |
| SCHEMBL182910 | 0.49 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101384183-B | Compounds comprising linked heteroaryl moieties and their use as novel umami flavor modifiers, tastants and taste enhancers for comestible compositions | SENOMYX INC | 2012-07-04 | — | — | CN | disclosed |
| CN-101384183-A | Compounds comprising linked heteroaryl moieties and their use as novel umami flavor modifiers, tastants and taste enhancers for comestible compositions | SENOMYX INC (US) | 2009-03-11 | — | — | CN | disclosed |