⚠ 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 | |
|---|---|---|---|---|
| Acetone SCHEMBL28506095 | 0.81 | TRPA1 (0.47) | — | |
| SCHEMBL8866037 | 0.79 | TRPA1 (0.48) | — | |
| SCHEMBL10846844 | 0.79 | — | — | |
| SCHEMBL11527326 | 0.78 | MAPT (0.46) | — | |
| SCHEMBL1629796 | 0.77 | — | — | |
| SCHEMBL142183 | 0.77 | — | — | |
| Methylamine SCHEMBL27945126 | 0.76 | TRPA1 (0.47) | — | |
| SCHEMBL30837248 | 0.76 | HSD17B1 (0.55) | — | |
| SCHEMBL27339510 | 0.76 | KCNK3 (0.46) | — | |
| SCHEMBL5737770 | 0.76 | ADORA2A (0.46) | — |
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 484 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119552042-A | Preparation method of deuterated furan | 浙大宁波理工学院 | 2025-03-04 | — | — | CN | claimed |
| CN-118184724-A | Ocotill type sapogenin heterocyclic derivative with anti-inflammatory activity, and preparation method and application thereof | 烟台大学 | 2024-06-14 | — | — | CN | claimed |
| US-20100179343-A1 | METHOD OF PRODUCING AN OPTICALLY ACTIVE CYANOHYDRIN DERIVATIVE | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2010-07-15 | — | — | US | claimed |
| CN-101663256-A | Process for producing optically active cyanohydrin derivative | AGENCY SCIENCE TECH & RES | 2010-03-03 | — | — | CN | claimed |
| WO-2008121074-A1 | METHOD OF PRODUCING AN OPTICALLY ACTIVE CYANOHYDRIN DERIVATIVE | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2008-10-09 | — | — | WO | claimed |
| CN-119552042-A | Preparation method of deuterated furan | 浙大宁波理工学院 | 2025-03-04 | — | — | CN | disclosed |
| CN-119361001-A | Method for evaluating quality difference of cigarette products based on multidimensional space chemical fingerprint | 山西昆明烟草有限责任公司 | 2025-01-24 | — | — | CN | disclosed |
| CN-119359104-A | Method for evaluating quality stability of cigarette products based on multidimensional space chemical fingerprint | 山西昆明烟草有限责任公司 | 2025-01-24 | — | — | CN | disclosed |
| CN-114685473-B | 5-Alkyl-2-pyrazole-oxazolidine-4-ketone derivative and application thereof | 杭州百新生物医药科技有限公司 | 2024-10-29 | — | — | CN | disclosed |
| US-20240294876-A1 | METHODS FOR THE EXPANSION OF HUMAN GRANULOCYTE-MACROPHAGE PROGENITORS AND APPLICATIONS THEREOF | UNIV SOUTHERN CALIFORNIA (US) | 2024-09-05 | — | — | US | disclosed |
| CN-118184724-A | Ocotill type sapogenin heterocyclic derivative with anti-inflammatory activity, and preparation method and application thereof | 烟台大学 | 2024-06-14 | — | — | CN | disclosed |
| EP-4341386-A2 | METHODS FOR THE EXPANSION OF HUMAN GRANULOCYTEMACROPHAGE PROGENITORS AND APPLICATIONS THEREOF | University of Southern California (US) | 2024-03-27 | — | — | EP | disclosed |
| EP-0025819-B1 | SUBSTITUTED PYRAZOLO (1,5-A) PYRIMIDINES, AND THEIR PREPARATION | AMERICAN CYANAMID COMPANY (US) | 1983-10-12 | — | — | EP | disclosed |
| EP-0029103-B1 | 6- AND 8-HETEROARYL-1,2,4-TRIAZOLO(4,3-B)PYRIDAZINES | AMERICAN CYANAMID COMPANY (US) | 1983-05-18 | — | — | EP | disclosed |
| US-4374988-A | ANXIOLYTIC AGENTS | AMERICAN CYANAMID COMPANY (US) | 1983-02-22 | — | — | US | disclosed |
| US-4281000-A | Substituted pyrazolo (1,5-a)pyrimidines and their use as anxiolytic agents | AMERICAN CYANAMID COMPANY (US) | 1981-07-28 | — | — | US | disclosed |
| EP-0029103-A1 | 6- and 8-Heteroaryl-1,2,4-triazolo(4,3-b)pyridazines | AMERICAN CYANAMID COMPANY (US) | 1981-05-27 | — | — | EP | disclosed |
| US-4260756-A | TRANQUILIZERS | AMERICAN CYANAMID COMPANY (US) | 1981-04-07 | — | — | US | disclosed |
| EP-0025819-A1 | Substituted pyrazolo (1,5-a) pyrimidines, and their preparation | AMERICAN CYANAMID COMPANY (US) | 1981-04-01 | — | — | EP | disclosed |
| US-4175087-A | ENAMINOKETONES WITH ALKYLLITHIUM | ELI LILLY AND COMPANY (US) | 1979-11-20 | — | — | US | disclosed |