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 | |
|---|---|---|---|---|
| SCHEMBL5492705 | 0.97 | — | — | |
| Bromide SCHEMBL9390081 | 0.95 | — | — | |
| SCHEMBL2037813 | 0.78 | — | — | |
| Iodide SCHEMBL28489287 | 0.70 | — | — | |
| SCHEMBL23533887 | 0.69 | — | — | |
| Iodide SCHEMBL27518262 | 0.68 | — | — | |
| Iodide SCHEMBL28799666 | 0.68 | — | — | |
| Iodide SCHEMBL27895851 | 0.68 | — | — | |
| SCHEMBL28172563 | 0.67 | — | — | |
| SCHEMBL1105675 | 0.67 | — | — |
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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116514722-A | Benzimidazole derivatives as modulators of retinoic acid related orphan receptor gamma (ROR gamma) and pharmaceutical uses thereof | 江苏恒瑞医药股份有限公司 | 2023-08-01 | — | — | CN | disclosed |
| CN-112135611-B | Benzimidazole derivatives as modulators of retinoic acid-related orphan receptor gamma (ROR γ) and pharmaceutical uses thereof | 江苏恒瑞医药股份有限公司 | 2023-01-31 | — | — | CN | disclosed |
| CN-112135611-A | Benzimidazole derivatives as modulators of retinoic acid-related orphan receptor gamma (ROR γ) and pharmaceutical uses thereof | 江苏恒瑞医药股份有限公司 | 2020-12-25 | — | — | CN | disclosed |
| CN-105315224-B | Cyclopentylacrylic acid amide derivative | 杏林制药株式会社 | 2018-04-10 | — | — | CN | disclosed |
| CN-102089291-B | Cyclopentyl acrylamide derivative | 杏林制药株式会社 | 2016-08-17 | — | — | CN | disclosed |
| CN-105315224-A | Cyclopentylacrylamide derivative | KYORIN SEIYAKU KK | 2016-02-10 | — | — | CN | disclosed |
| CN-102089291-A | Cyclopentyl acrylamide derivative | TEIJIN PHARMA LTD | 2011-06-08 | — | — | CN | disclosed |
| CN-1960977-B | Quinazoline derivative | BANYU PHARMA CO LTD | 2010-07-21 | — | — | CN | disclosed |
| CN-101305009-A | Aza-substituted spirocyclic derivatives | BANYU PHARMA CO LTD (JP) | 2008-11-12 | — | — | CN | disclosed |
| CN-1960977-A | Quinazoline derivative | BANYU PHARMA CO LTD (JP) | 2007-05-09 | — | — | CN | disclosed |
| US-5108917-A | Hydrolysis of ester of ibuprofen by action of microorganism to form racemic isomers or esters or salts | GIST-BROCADES N.V. (NL) | 1992-04-28 | — | — | US | disclosed |
| EP-0274146-B1 | PROCESS FOR THE PREPARATION OF 2-ARYLPROPIONIC ACIDS | GIST-BROCADES N.V. (NL) | 1992-04-01 | — | — | EP | disclosed |
| US-5037751-A | Ability for stereoselective hydrolysis of naproxen ester; gene encoded enzyme | GIST-BROCADES N.V. (NL) | 1991-08-06 | — | — | US | disclosed |
| EP-0426656-A2 | Process for the preparation of 2-arylpropionic acids | GIST-BROCADES N.V. (NL) | 1991-05-08 | — | — | EP | disclosed |
| US-4886750-A | STEREOSELECTIVE HYDROLYSIS USING MICROORGANISMS | GIST-BROCADES N.V. (NL) | 1989-12-12 | — | — | US | disclosed |
| CN-1005150-B | 1, 5-benzothiazepine * derivatives as platelet aggregation inhibitors | 田道制药株式会社 | 1989-09-13 | — | — | CN | disclosed |
| EP-0299558-A1 | Process for the preparation of ibuprofen | GIST-BROCADES N.V. (NL) | 1989-01-18 | — | — | EP | disclosed |
| EP-0274146-A1 | Process for the preparation of 2-arylpropionic acids | GIST-BROCADES N.V. (NL) | 1988-07-13 | — | — | EP | disclosed |
| EP-0233656-A1 | Microbial esterase and process for the preparation of 2-arylpropionic acids | GIST-BROCADES N.V. (NL) | 1987-08-26 | — | — | EP | disclosed |
| CN-85103395-A | Preparation of 1, 5-benzothiazepine * derivatives as platelet aggregation inhibitors | — | 1986-12-10 | — | — | CN | disclosed |