⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23223 | 0.81 | — | — | |
| SCHEMBL1521945 | 0.80 | IMPDH2 (0.37) | — | |
| SCHEMBL10846367 | 0.76 | PARP1 (0.36) | — | |
| SCHEMBL10855091 | 0.76 | CSNK2A1 (0.35) | — | |
| SCHEMBL4158021 | 0.72 | ADORA2A (0.33) | — | |
| SCHEMBL2894544 | 0.70 | — | — | |
| SCHEMBL290676 | 0.70 | IMPDH2 (0.32) | — | |
| SCHEMBL196321 | 0.68 | LPL (0.41) | — | |
| SCHEMBL17592087 | 0.67 | ERN1 (0.33) | — | |
| SCHEMBL7191487 | 0.67 | LPL (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
Appears in 2844 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 |
|---|---|---|---|---|---|---|---|
| CN-118125957-A | Cyclopentylamine compound with novel structure and preparation method and application thereof | 遵义医科大学 | 2024-06-04 | — | — | CN | claimed |
| CN-117164497-A | Synthesis method of pyrrole-2-ketone compound | 华南理工大学 | 2023-12-05 | — | — | CN | claimed |
| CN-116621756-A | Preparation method of 3, 3-difluoro-gamma-lactam compound | 遵义医科大学 | 2023-08-22 | — | — | CN | claimed |
| US-RE49118-E1 | Material for organic electroluminescence device and electroluminescence device employing the same | IDEMITSU KOSAN CO., LTD. (JP) | 2022-06-28 | — | — | US | claimed |
| CN-112390811-B | Dithia-anthrone derivative and preparation method and application thereof | 中国科学院理化技术研究所 | 2022-03-04 | — | — | CN | claimed |
| CN-114057711-A | Anthracene ketone spiro derivative and preparation method and application thereof | 中国科学院理化技术研究所 | 2022-02-18 | — | — | CN | claimed |
| CN-107556298-B | Aromatic heterocyclic derivative, material for organic electroluminescent element, and organic electroluminescent element | 出光兴产株式会社 | 2021-12-21 | — | — | CN | claimed |
| CN-113024349-A | 3, 3-difluoro-1, 5-hexadiene compound and preparation method and application thereof | 南京工业大学 | 2021-06-25 | — | — | CN | claimed |
| CN-107586290-B | Aromatic heterocyclic derivative, material for organic electroluminescent element, and organic electroluminescent element | 出光兴产株式会社 | 2021-05-11 | — | — | CN | claimed |
| CN-112390811-A | Dithia-anthrone derivative and preparation method and application thereof | 中国科学院理化技术研究所 | 2021-02-23 | — | — | CN | claimed |
| CN-1134697-A | Pyrimidine-sulfanyl and alkyl ether compounds | UPJOHN CO (US) | 1996-10-30 | — | — | CN | claimed |
| EP-0728130-A1 | PYRIMIDINE-THIOALKYL AND ALKYLETHER COMPOUNDS | PHARMACIA & UPJOHN COMPANY (US) | 1996-08-28 | — | — | EP | claimed |
| WO-1996019469-A1 | DIARYL-2-(5H)-FURANONES AS COX-2 INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1996-06-27 | — | — | WO | claimed |
| WO-1995026347-A1 | THIAZOLIDINES AND OXAZOLIDINES SUBSTITUTED BY A PYRIDINE RING AND THEIR USE AS HYPOGLYCEMIC AGENTS | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 1995-10-05 | — | — | WO | claimed |
| WO-1995013267-A1 | PYRIMIDINE-THIOALKYL AND ALKYLETHER COMPOUNDS | THE UPJOHN COMPANY (US) | 1995-05-18 | — | — | WO | claimed |
| US-5276139-A | Antiinflammatory and antidegenerative diseases | MERCK & CO., INC. (US) | 1994-01-04 | — | — | US | claimed |
| US-5274080-A | Binds to a urea-containing hapten | MERCK & CO., INC. (US) | 1993-12-28 | — | — | US | claimed |
| US-5229267-A | Polymorphonuclear leukocytes, decomplexing, radioimmunoassay | MERCK & CO., INC. (US) | 1993-07-20 | — | — | US | claimed |
| EP-0529719-A1 | Assay for evaluating inhibition of PMN elastase by N-Substituted Azetidinones | MERCK & CO. INC. (US) | 1993-03-03 | — | — | EP | claimed |
| EP-0139917-A1 | Pharmaceutical preparations, acylated hydrazine derivatives, methods for their preparation | CIBA-GEIGY AG (CH) | 1985-05-08 | — | — | EP | claimed |