Known targets — ChEMBL curated mechanism
ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG
The experimentally established mechanism targets of Iodide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL294017 | 0.97 | — | — | |
| SCHEMBL8325168 | 0.97 | — | — | |
| SCHEMBL10206077 | 0.97 | — | — | |
| Ammonia Solution, Strong SCHEMBL28877045 | 0.95 | — | — | |
| Bromide SCHEMBL28167059 | 0.95 | — | — | |
| SCHEMBL8542618 | 0.95 | — | — | |
| Bromide SCHEMBL29261105 | 0.93 | CYP1A2 (0.45) | — | |
| Iodide SCHEMBL4422616 | 0.93 | CYP1A2 (0.55) | — | |
| SCHEMBL2662411 | 0.90 | — | — | |
| SCHEMBL8329095 | 0.90 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108586723-A | Polycondensation resin and optical film formed therefrom | 三菱化学株式会社 | 2018-09-28 | — | — | CN | disclosed |
| CN-106062035-B | Polycondensation resin and optical film formed therefrom | 三菱化学株式会社 | 2018-05-29 | — | — | CN | disclosed |
| CN-106986748-A | Oligofluorenediols, oligofluorenediaryl esters, and methods for producing these | 三菱化学株式会社 | 2017-07-28 | — | — | CN | disclosed |
| CN-106062035-A | Polycondensation resin and optical film formed therefrom | 三菱化学株式会社 | 2016-10-26 | — | — | CN | disclosed |