⚠ 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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL28910588 | 0.97 | — | — | |
| SCHEMBL587850 | 0.88 | — | — | |
| SCHEMBL17459903 | 0.88 | — | — | |
| SCHEMBL4584235 | 0.85 | — | — | |
| SCHEMBL10859923 | 0.80 | — | — | |
| Pyridine SCHEMBL20304439 | 0.79 | TSHR (0.43) | — | |
| SCHEMBL3432761 | 0.78 | — | — | |
| SCHEMBL1603252 | 0.74 | — | — | |
| SCHEMBL1603345 | 0.74 | — | — | |
| SCHEMBL1603047 | 0.74 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-9173840-A | — | — | None | — | — | JP | disclosed |
| CN-102899028-B | Metering type fluorinion fluorescence probe and preparation method | UNIV HANGZHOU NORMAL | 2014-06-25 | — | — | CN | disclosed |
| CN-102899028-A | Metering type fluorinion fluorescence probe and preparation method | UNIV HANGZHOU NORMAL | 2013-01-30 | — | — | CN | disclosed |
| JP-H09173840-A | WATER PHOTOREDUCING ELEMENT | TOKYO GAS CO LTD | 1997-07-08 | — | — | JP | disclosed |