⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13585547 | 1.00 | — | — | |
| SCHEMBL447922 | 1.00 | — | — | |
| Ammonia Solution, Strong SCHEMBL3064049 | 0.96 | — | — | |
| Acetaldehyde SCHEMBL31365039 | 0.87 | TSHR (0.47) | — | |
| SCHEMBL93580 | 0.80 | — | — | |
| SCHEMBL31421734 | 0.80 | — | — | |
| SCHEMBL23312 | 0.80 | — | — | |
| SCHEMBL29956233 | 0.80 | — | — | |
| SCHEMBL455386 | 0.80 | ALDH1A1 (0.53) | — | |
| SCHEMBL11256487 | 0.80 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114561258-B | Cleaning agent for alkaline washing tower of ethylene device | 浙江杭化科技股份有限公司 | 2023-11-17 | — | — | CN | claimed |
| EP-0793481-B1 | COSMETIC COMPOSITION CONTAINING HYDROXY ALKANOATE DERIVATIVES | UNILEVER PLC (GB) | 2004-06-02 | — | — | EP | claimed |
| CN-114561258-B | Cleaning agent for alkaline washing tower of ethylene device | 浙江杭化科技股份有限公司 | 2023-11-17 | — | — | CN | disclosed |
| EP-3803400-B1 | IN VITRO METHOD FOR THE DIAGNOSIS OR DETECTION OF NON-TUBERCULOUS MYCOBACTERIA | FUNDACIO INST DINVESTIGACIO EN CIENCIES DE LA SALUT GERMANS TRIAS I PUJOL (ES) | 2023-08-09 | — | — | EP | disclosed |
| CN-114746092-A | D-amphetamine compounds, compositions, and methods of making and using the same | 肯法姆股份有限公司 | 2022-07-12 | — | — | CN | disclosed |
| CN-102471489-B | Supermolecule polymer and the compositions comprising described polymer | 罗地亚经营管理公司 | 2016-08-03 | — | — | CN | disclosed |
| US-9012567-B2 | Supramolecular polymers and compositions containing said polymers | RHODIA OPERATIONS (FR) | 2015-04-21 | — | — | US | disclosed |
| US-20120289652-A1 | SUPRAMOLECULAR POLYMERS AND COMPOSITIONS CONTAINING SAID POLYMERS | RHODIA OPERATIONS (FR) | 2012-11-15 | — | — | US | disclosed |
| EP-0308983-A2 | NMR imaging with Mn(II) coordination compositions | SALUTAR, INC. (US) | 1989-03-29 | — | — | EP | disclosed |
| US-4230854-A | HYPOTENSIVE AGENTS; ADRENERGIC BLOCKING AGENTS | SOCIETA FARMACEUTICI ITALIA S.P.A. (IT) | 1980-10-28 | — | — | US | disclosed |