Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
The experimentally established mechanism targets of Bromide. 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 | |
|---|---|---|---|---|
| SCHEMBL380245 | 0.97 | — | — | |
| Iodide SCHEMBL1842396 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL3900876 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL8067868 | 0.92 | — | — | |
| SCHEMBL5398347 | 0.88 | FDPS (0.36) | — | |
| SCHEMBL19975364 | 0.88 | FDPS (0.36) | — | |
| Perchlorate SCHEMBL6675047 | 0.88 | FDPS (0.37) | — | |
| SCHEMBL4455164 | 0.84 | FDPS (0.39) | — | |
| SCHEMBL1768366 | 0.84 | FDPS (0.39) | — | |
| Sulfuric Acid SCHEMBL6003622 | 0.83 | FDPS (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111100070-A | Cationic N-substituted aniline ionic liquid and preparation method thereof | 北京师范大学 | 2020-05-05 | — | — | CN | claimed |
| EP-1663921-A2 | METHOD FOR PRODUCING HALOALKANES FROM ALCOHOLS | BASF AKTIENGESELLSCHAFT (DE) | 2006-06-07 | — | — | EP | claimed |
| WO-2005026089-A2 | METHOD FOR PRODUCING HALOALKANES FROM ALCOHOLS | BASF AKTIENGESELLSCHAFT (DE) | 2005-03-24 | — | — | WO | claimed |
| US-20240152047-A1 | HIGH REFRACTIVE INDEX MATERIALS | U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT | 2024-05-09 | — | — | US | disclosed |
| EP-4341315-A1 | IMIDAZOLIUM-BASED POLY(IONIC LIQUID)S AND USE THEREFORE | Versum Materials US, LLC (US) | 2024-03-27 | — | — | EP | disclosed |
| CN-112794822-B | Cationic N-substituted aniline ionic liquid, polyionic liquid thereof, preparation method and application | 北京师范大学（CN） | 2023-01-13 | — | — | CN | disclosed |
| CN-114570219-A | Pollution-resistant separation membrane with ionic liquid layer on surface and preparation method thereof | 浙江大学 | 2022-06-03 | — | — | CN | disclosed |
| CN-112794822-A | Cationic N-substituted aniline ionic liquid, polyionic liquid thereof, preparation method and application | 北京师范大学 | 2021-05-14 | — | — | CN | disclosed |
| CN-107188869-B | Fluorine-containing epoxy resin monomer, prepolymer and preparation and application of initiator thereof | 华中师范大学 | 2020-07-24 | — | — | CN | disclosed |
| CN-111100070-A | Cationic N-substituted aniline ionic liquid and preparation method thereof | 北京师范大学 | 2020-05-05 | — | — | CN | disclosed |
| US-10308574-B2 | Reduction catalyst and chemical reactor | KABUSHIKI KAISHA TOSHIBA (JP) | 2019-06-04 | — | — | US | disclosed |
| US-20170369405-A1 | REDUCTION CATALYST AND CHEMICAL REACTOR | KABUSHIKI KAISHA TOSHIBA (JP) | 2017-12-28 | — | — | US | disclosed |