⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16158874 | 1.00 | — | — | |
| SCHEMBL8277451 | 1.00 | — | — | |
| SCHEMBL1782638 | 0.87 | ALDH1A1 (0.40) | — | |
| SCHEMBL8059213 | 0.82 | — | — | |
| SCHEMBL1782201 | 0.78 | KISS1R (0.32) | — | |
| SCHEMBL1785002 | 0.78 | SLC1A3 (0.35) | — | |
| SCHEMBL1782828 | 0.78 | KISS1R (0.37) | — | |
| SCHEMBL361589 | 0.77 | — | — | |
| SCHEMBL1336542 | 0.77 | — | — | |
| SCHEMBL185354 | 0.77 | — | — |
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 170 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2463374-A2 | Isolated alcohol dehydrogenase enzymes and uses thereof | Bio Architecture Lab, Inc. (US) | 2012-06-13 | — | — | EP | claimed |
| EP-2195440-A2 | BIOFUEL PRODUCTION | Bio Architecture Lab, Inc. (US) | 2010-06-16 | — | — | EP | claimed |
| US-20090155873-A1 | BIOFUEL PRODUCTION | BIO ARCHITECTURE LAB, INC. (US) | 2009-06-18 | — | — | US | claimed |
| US-20090139134-A1 | BIOFUEL PRODUCTION | BIO ARCHITECTURE LAB, INC. (US) | 2009-06-04 | — | — | US | claimed |
| WO-2009046370-A2 | BIOFUEL PRODUCTION | BIO ARCHITECTURE LAB, INC. (US) | 2009-04-09 | — | — | WO | claimed |
| WO-2009046375-A2 | BIOFUEL PRODUCTION | BIO ARCHITECTURE LAB, INC. (US) | 2009-04-09 | — | — | WO | claimed |
| EP-0952140-B1 | 2-Hydroxy-5-methyl-hexan-3-one and 3-hydroxy-5-methyl-hexan-2-one | GIVAUDAN SA (CH) | 2004-04-28 | — | — | EP | claimed |
| US-6426108-B1 | CHLORINATION KETONE USING SULFURYL CHLORIDE; ESTERIFICATION; HYDROLYSIS | GIVAUDAN SA (CH) | 2002-07-30 | — | — | US | claimed |
| US-6123974-A | 2-HYDROXY-5-METHYL-HEXAN-3-ONE AND MIXTURES WITH 3-HYDROXY-5-METHYL-HEXAN-2-ONE; USE AS FLAVORING AND MASKING AGENTS SUCH AS FOR SOYBEAN-BASED FOOD AND BEVERAGES | GIVAUDAN ROURE (INTERNATIONAL) SA (CH) | 2000-09-26 | — | — | US | claimed |
| EP-0952140-A1 | Hydroxy-methyl-hexanones | Givaudan Roure (International) S.A. (CH) | 1999-10-27 | — | — | EP | claimed |
| EP-3230463-B2 | RAPID PRETREATMENT | APALTA PATENTS OUE (EE) | 2025-07-16 | — | — | EP | disclosed |
| US-20240425893-A1 | RAPID PRETREATMENT | Apalta Patents OÜ (EE) | 2024-12-26 | — | — | US | disclosed |
| US-20240410055-A1 | METHOD AND FORMULATION FOR PREPARING OPTICAL METAL OXIDE LAYERS | MERCK PATENT GMBH (DE) | 2024-12-12 | — | — | US | disclosed |
| US-12054761-B2 | Rapid pretreatment | Apalta Patents OÜ (EE) | 2024-08-06 | — | — | US | disclosed |
| CN-118076767-A | Method and formulation for producing an optical metal oxide layer | 默克专利有限公司 | 2024-05-24 | — | — | CN | disclosed |
| US-6123974-A | 2-HYDROXY-5-METHYL-HEXAN-3-ONE AND MIXTURES WITH 3-HYDROXY-5-METHYL-HEXAN-2-ONE; USE AS FLAVORING AND MASKING AGENTS SUCH AS FOR SOYBEAN-BASED FOOD AND BEVERAGES | GIVAUDAN ROURE (INTERNATIONAL) SA (CH) | 2000-09-26 | — | — | US | disclosed |
| JP-2000053607-A | HYDROXY-METHYL-HEXANONE | GIVAUDAN ROURE INTERNATL SA | 2000-02-22 | — | — | JP | disclosed |
| CN-1235150-A | Hydroxy-methyl-hexanones | GIVAUDAN ROURE INT (CH) | 1999-11-17 | — | — | CN | disclosed |
| EP-0952140-A1 | Hydroxy-methyl-hexanones | Givaudan Roure (International) S.A. (CH) | 1999-10-27 | — | — | EP | disclosed |
| EP-0952140-A1 | Hydroxy-methyl-hexanones | Givaudan Roure (International) S.A. (CH) | 1999-10-27 | — | — | EP | disclosed |