⚠ 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 | |
|---|---|---|---|---|
| Butyl Alcohol SCHEMBL27610842 | 0.92 | ALDH1A1 (0.85) | — | |
| Butyl Alcohol SCHEMBL10750856 | 0.92 | — | — | |
| Butyl Alcohol SCHEMBL27729241 | 0.92 | — | — | |
| Butyl Alcohol SCHEMBL2263798 | 0.92 | ALDH1A1 (1.00) | — | |
| Butyl Alcohol SCHEMBL9725477 | 0.92 | ALDH1A1 (1.00) | — | |
| Butyl Alcohol SCHEMBL29688387 | 0.92 | — | — | |
| Butyl Alcohol SCHEMBL29688432 | 0.92 | — | — | |
| Butyl Alcohol SCHEMBL30877879 | 0.92 | — | — | |
| Butyl Alcohol SCHEMBL532 | 0.92 | — | — | |
| Butyl Alcohol SCHEMBL1270924 | 0.89 | ALDH1A1 (0.79) | — |
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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-62012791-A | — | — | None | — | — | JP | disclosed |
| US-20150342976-A1 | METHOD FOR PREPARATION OF HIGHLY PURE ASIATICOSIDE COMPOSITION FROM CENTELLA ASIATICA AND A METHOD OF USE THEREOF | INDUS BIOTECH PRIVATE LIMITED (IN) | 2015-12-03 | — | — | US | disclosed |
| US-9139608-B2 | Method for preparation of highly pure asiaticoside composition from Centella asiatica and a method of use thereof | INDUS BIOTECH PRIVATE LIMITED (IN) | 2015-09-22 | — | — | US | disclosed |
| US-7872133-B2 | Tricyclic heterocycle compound | ONO PHARMACEUTICAL CO., LTD. (JP) | 2011-01-18 | — | — | US | disclosed |
| US-20100168406-A1 | USE OF GINSENOSIDE Rb2 MONOMER IN THE MANUFACTURE OF MEDICAMENTS FOR THROMBOLYSIS | CAI ZAIXI | 2010-07-01 | — | — | US | disclosed |
| US-7709612-B2 | Metal chelating compositions for protein purification, detection or binding | SIGMA-ALDRICH CO. (US) | 2010-05-04 | — | — | US | disclosed |
| US-20070276133-A1 | 5-hydroxytryptophol (5-HTOL) derivatives, antibodies, immunoassays and detection of recent alcohol consumption | AXIS BIOCHEMICALS ASA (NO) | 2007-11-29 | — | — | US | disclosed |
| US-20060154944-A1 | Novel tricyclic heterocycle compound | ONO PHARMACEUTICAL CO., LTD. (JP) | 2006-07-13 | — | — | US | disclosed |
| US-20060148090-A1 | Metal chelating compositions for protein purification, detection or binding | SIGMA-ALDRICH CO. (US) | 2006-07-06 | — | — | US | disclosed |
| US-20060100420-A1 | 5-hydroxytryptophol (5-HTOL) derivatives, antibodies, immunoassays and detection of recent alcohol consumption | AXIS BIOCHEMICALS ASA (NO) | 2006-05-11 | — | — | US | disclosed |
| US-4456595-A | HYPOTENSIVE AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1984-06-26 | — | — | US | disclosed |
| EP-0079934-A4 | ANTIGENIC LINEAR PEPTIDE COMPOUNDS. | UNIV NORTHWESTERN (US) | 1983-12-23 | — | — | EP | disclosed |
| US-4388304-A | OLIGOPEPTIDES, HYPOTENSIVE | RICHTER GEDEON VEGYESZETI GYAR RT (HU) | 1983-06-14 | — | — | US | disclosed |
| EP-0079934-A1 | ANTIGENIC LINEAR PEPTIDE COMPOUNDS. | UNIV NORTHWESTERN (US) | 1983-06-01 | — | — | EP | disclosed |
| US-4369178-A | Glucosamine peptide derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1983-01-18 | — | — | US | disclosed |
| WO-1982004250-A1 | ANTIGENIC LINEAR PEPTIDE COMPOUNDS | UNIV NORTHWESTERN (US) | 1982-12-09 | — | — | WO | disclosed |
| US-4330532-A | HYPOTENSIVE AGENTS | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1982-05-18 | — | — | US | disclosed |
| US-4272432-A | Claudogenic-interceptive nonapeptide | AMERICAN HOME PRODUCTS CORPORATION (US) | 1981-06-09 | — | — | US | disclosed |
| US-4143133-A | PYROGLUTAMIC ACID, HISTIDINE, TRYPTOPHAN, SERINE, TYROSINE, 2-CYCLOHEXYLGLYCINE, LEUCINE OR N-METHYLLEUCINE, ARGININE, PROLINE N-ETHYLAMIDE; ANTIFERTILITY AND ABORTIVE AGENTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1979-03-06 | — | — | US | disclosed |
| US-4111924-A | REACTION WITH MERCURIC ACETATE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1978-09-05 | — | — | US | disclosed |