⚠ 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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL28223601 | 0.97 | CES2 (0.50) | — | |
| SCHEMBL5948357 | 0.93 | CES1 (0.46) | — | |
| SCHEMBL1272620 | 0.92 | CES2 (0.60) | — | |
| SCHEMBL827134 | 0.90 | CES2 (0.64) | — | |
| SCHEMBL23950237 | 0.90 | CES2 (0.64) | — | |
| SCHEMBL23950236 | 0.90 | CES2 (0.64) | — | |
| SCHEMBL23950441 | 0.90 | CES2 (0.64) | — | |
| SCHEMBL21448801 | 0.90 | CES2 (0.64) | — | |
| SCHEMBL8773299 | 0.90 | CES2 (0.64) | — | |
| SCHEMBL14477972 | 0.90 | CES2 (0.64) | — |
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
Appears in 2002 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4444108-B1 | ALDEHYDE MIXTURES FOR FLAVOUR IMPROVEMENT | SYMRISE AG (DE) | 2025-09-10 | — | — | EP | claimed |
| WO-2025150071-A1 | A TERNARY INSECTICIDAL COMPOSITION FOR INSECTS, PESTS AND MITES | RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) | 2025-07-17 | — | — | WO | claimed |
| WO-2025109628-A1 | A SYNERGISTIC TERNARY INSECTICIDAL COMPOSITION | RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) | 2025-05-30 | — | — | WO | claimed |
| US-20250163014-A1 | PRODUCTION METHOD FOR EPISULFIDE COMPOUND | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2025-05-22 | — | — | US | claimed |
| CN-119881168-A | Method for identifying soybean new and old based on volatile odor compound | 中储粮镇江质检中心有限公司 | 2025-04-25 | — | — | CN | claimed |
| CN-119715879-A | Method for measuring meat flavor compound by using TF-SPME | 中国农业科学院北京畜牧兽医研究所 | 2025-03-28 | — | — | CN | claimed |
| CN-115656362-B | Evaluation method of fragrance intensity of popcorn fragrance in rice | 中国水稻研究所 | 2025-03-18 | — | — | CN | claimed |
| CN-119359335-A | Model method for predicting cheese favorites based on GC-MS combined with machine learning | 北京工商大学 | 2025-01-24 | — | — | CN | claimed |
| EP-4491621-A1 | PRODUCTION METHOD FOR EPISULFIDE COMPOUND | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2025-01-15 | — | — | EP | claimed |
| CN-118566389-B | Classification and classification method of different-flavor thin-skin melons based on flavor histology | 中国农业科学院农业质量标准与检测技术研究所 | 2024-11-26 | — | — | CN | claimed |
| US-20010048977-A1 | Manufacturing method for multilayer fluorescent information carriers | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2001-12-06 | — | — | US | claimed |
| WO-2001081459-A1 | LIQUID ANTIOZONANTS AND RUBBER COMPOSITIONS CONTAINING SAME | UNIROYAL CHEMICAL COMPANY, INC. (US) | 2001-11-01 | — | — | WO | claimed |
| WO-2001053065-A1 | MANUFACTURING METHOD FOR MULTILAYER FLUORESCENT INFORMATION CARRIERS | TRID STORE IP, LLC (US) | 2001-07-26 | — | — | WO | claimed |
| EP-0866788-A1 | 1,3-OXAZIN-4-ONE DERIVATIVES AS HERBICIDES | RHONE-POULENC AGRICULTURE LTD. (GB) | 1998-09-30 | — | — | EP | claimed |
| US-5672641-A | CURABLE POLYSILOXANE COATING | PPG INDUSTRIES, INC. (US) | 1997-09-30 | — | — | US | claimed |
| WO-1997021688-A1 | 1,3-OXAZIN-4-ONE DERIVATIVES AS HERBICIDES | RHONE-POULENC AGRICULTURE LTD. (GB) | 1997-06-19 | — | — | WO | claimed |
| WO-1996023740-A2 | SECONDARY COATING COMPOSITIONS FOR GLASS FIBERS, GLASS FIBERS COATED WITH THE SAME AND COMPOSITES REINFORCED THEREWITH | PPG INDUSTRIES, INC. (US) | 1996-08-08 | — | — | WO | claimed |
| WO-1992002499-A1 | METHOD FOR PREPARING INDOLENINIUM HALIDE | PPG INDUSTRIES, INC. (US) | 1992-02-20 | — | — | WO | claimed |
| US-5039823-A | Method for preparing indoleninium halide | PPG INDUSTRIES, INC. (US) | 1991-08-13 | — | — | US | claimed |
| US-4318837-A | BLEND OF SATURATED POLYESTER, UNDATURATED POLYESTER AND POLYISOCYANATE | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1982-03-09 | — | — | US | claimed |