Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Butane. 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 | |
|---|---|---|---|---|
| Butane SCHEMBL27501711 | 1.00 | TSHR (0.40) | — | |
| Butane SCHEMBL27296466 | 1.00 | — | — | |
| Butane SCHEMBL29287281 | 1.00 | TSHR (0.40) | — | |
| Butane SCHEMBL30942544 | 0.93 | — | — | |
| Butane SCHEMBL5129860 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL421381 | 0.93 | — | — | |
| Butane SCHEMBL9442188 | 0.93 | — | — | |
| Butane SCHEMBL8412888 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL8463912 | 0.93 | — | — | |
| Butane SCHEMBL27543855 | 0.93 | — | — |
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 87 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119113821-A | Preparation method of multi-channel chabazite molecular sieve membrane | 南京工业大学 | 2024-12-13 | — | — | CN | claimed |
| CN-111635313-B | Method for preparing electrolyte solvent dimethyl carbonate by oxidizing methyl acetate under catalysis of selenium | 扬州大学 | 2022-10-11 | — | — | CN | claimed |
| CN-111883679-B | Blue-light perovskite light-emitting diode based on total bromine proportion and preparation method thereof | 苏州大学 | 2022-07-19 | — | — | CN | claimed |
| CN-110590562-B | Synthesis method and antibacterial application of symmetrical gemini quaternary ammonium salt containing hydrogenated nopyl | 江西农业大学 | 2020-11-13 | — | — | CN | claimed |
| CN-111883679-A | Blue-light perovskite light-emitting diode based on total bromine proportion and preparation method thereof | 苏州大学 | 2020-11-03 | — | — | CN | claimed |
| CN-111635313-A | Method for preparing electrolyte solvent dimethyl carbonate by oxidizing methyl acetate under catalysis of selenium | 扬州大学 | 2020-09-08 | — | — | CN | claimed |
| CN-110590562-A | Synthetic method and antibacterial application of symmetrical gemini quaternary ammonium iron containing hydrogenated nopyl | 江西农业大学 | 2019-12-20 | — | — | CN | claimed |
| CN-101811066-A | Catalyst for synthesizing 5-hydroxymethylfurfural by hexose dehydration and method for synthesizing 5-hydroxymethylfurfural | UNIV TIANJIN | 2010-08-25 | — | — | CN | claimed |
| CN-100532367-C | High stack-density sheet structural melamine cyanurate and production method and application for flame-resistant material | HANGZHOU JLS FLAME RETARDANTS (CN) | 2009-08-26 | — | — | CN | claimed |
| CN-101037417-A | High stack-density sheet structural melamine cyanurate and production method and application for flame-resistant material | HANGZHOU JLS FLAME RETARDANTS (CN) | 2007-09-19 | — | — | CN | claimed |
| WO-2004038084-A2 | FABRIC CARE COMPOSITIONS | THE CLOROX COMPANY (US) | 2004-05-06 | — | — | WO | claimed |
| US-20040063597-A1 | Fabric care compositions | CLOROX COMPANY, THE | 2004-04-01 | — | — | US | claimed |
| US-6583234-B2 | Ink jet printing; reacting allyl bromide with diethylamine to form allyldiethylamine, quaternization with allyl bromide to form diallyl diethylammonium bromide; solution polymerization | XEROX CORPORATION | 2003-06-24 | — | — | US | claimed |
| US-20030027948-A1 | Process for preparing waterfastness additive | XEROX CORPORATION | 2003-02-06 | — | — | US | claimed |
| CN-119185587-A | Enhanced penetration type dual-response nanoparticle for co-delivering chemotherapeutic drugs and gene drugs, and preparation method and application thereof | 复旦大学 | 2024-12-27 | — | — | CN | disclosed |
| CN-117545585-A | Solder paste and method for manufacturing electronic device | 千住金属工业株式会社 | 2024-02-09 | — | — | CN | disclosed |
| CN-115925437-B | Integral honeycomb molecular sieve for VOCs removal and preparation and application thereof | 上海绿强新材料有限公司 | 2023-12-19 | — | — | CN | disclosed |
| EP-0305065-A2 | Isotropic fabric softener composition containing fabric mildewstat | The Clorox Company (US) | 1989-03-01 | — | — | EP | disclosed |
| US-4440923-A | OXIDATION OF SUBSTITUTED PHENOL IN PRESENCE OF COPPER AMINE CATALYST, POLYVALENT ALCOHOL ACTIVATOR, AND ALKALI-(OR ALKALI EARTH METAL-) HYDROXIDES | CHEMISCHE WERKE HULS AG (DE) | 1984-04-03 | — | — | US | disclosed |
| US-4282220-A | Cephem derivatives | HOECHST AKTIENGESELLSCHAFT (DE) | 1981-08-04 | — | — | US | disclosed |