Known targets — ChEMBL curated mechanism
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 | |
|---|---|---|---|---|
| SCHEMBL27346657 | 0.96 | TSHR (0.50) | — | |
| SCHEMBL27259142 | 0.96 | TSHR (0.50) | — | |
| SCHEMBL5991 | 0.96 | — | — | |
| SCHEMBL27308161 | 0.96 | TSHR (0.50) | — | |
| SCHEMBL8758797 | 0.92 | — | — | |
| Methane SCHEMBL472929 | 0.92 | — | — | |
| Bromide SCHEMBL2124260 | 0.92 | — | — | |
| Ammonia Solution, Strong SCHEMBL60731 | 0.92 | — | — | |
| SCHEMBL1034875 | 0.92 | — | — | |
| Water SCHEMBL3365863 | 0.92 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7229479-B2 | Method of coloring porous material | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2007-06-12 | — | — | US | disclosed |
| US-20060162095-A1 | Method of colouring porous material | CIBA SPECIALTY CHEMICALS CORP. | 2006-07-27 | — | — | US | disclosed |
| EP-1333792-A4 | NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING | P & G CLAIROL INC (US) | 2005-08-10 | — | — | EP | disclosed |
| EP-1534226-A1 | METHOD OF COLOURING POROUS MATERIAL | Ciba SC Holding AG (CH) | 2005-06-01 | — | — | EP | disclosed |
| WO-2004019897-A1 | METHOD OF COLOURING POROUS MATERIAL | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2004-03-11 | — | — | WO | disclosed |
| CN-1474679-A | Novel couplers for oxidative hair dyeing | P&G | 2004-02-11 | — | — | CN | disclosed |
| US-6673966-B2 | FOR USE IN HAIR COLORING FORMULATIONS | THE PROCTER & GAMBLE COMPANY | 2004-01-06 | — | — | US | disclosed |
| EP-1333792-A1 | NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING | P & G-Clairol, Inc. (US) | 2003-08-13 | — | — | EP | disclosed |
| US-20020100127-A1 | Novel coupler for use in oxidative hair dyeing | WELLA OPERATIONS US, LLC | 2002-08-01 | — | — | US | disclosed |
| WO-2002039967-A1 | NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING | P&G - CLAIROL, INC. (US) | 2002-05-23 | — | — | WO | disclosed |
| EP-0002004-B1 | PROCESS FOR THE MANUFACTURE OF FLUORINATED CATIONIC COMPOUNDS AND THEIR USE AS SURFACTANTS | CIBA-GEIGY AG (CH) | 1982-03-24 | — | — | EP | disclosed |
| EP-0002004-A1 | Process for the manufacture of fluorinated cationic compounds and their use as surfactants | CIBA-GEIGY AG (CH) | 1979-05-30 | — | — | EP | disclosed |