⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30668848 | 1.00 | — | — | |
| Acetic Acid SCHEMBL28049616 | 0.88 | ALDH1A1 (0.47) | — | |
| Phosphonic Acid SCHEMBL9637901 | 0.88 | MEN1 (0.41) | — | |
| SCHEMBL9637905 | 0.82 | MEN1 (0.38) | — | |
| Propane SCHEMBL9823974 | 0.82 | NOS3 (0.39) | — | |
| SCHEMBL14749003 | 0.81 | — | — | |
| SCHEMBL23183097 | 0.80 | — | — | |
| SCHEMBL29896037 | 0.79 | ALDH1A1 (0.50) | — | |
| SCHEMBL2829221 | 0.79 | ALDH1A1 (0.50) | — | |
| SCHEMBL9548473 | 0.79 | CYP2A6 (0.50) | — |
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 374 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20260000692-A1 | Substituted N-(Pyridin-2-yl)Acetamide Derivatives as CDK12/13 Inhibitors | AURIGENE ONCOLOGY LIMITED (IN) | 2026-01-01 | — | — | US | claimed |
| CN-115286799-B | Triblock polysiloxane quaternary ammonium salt and preparation method thereof | 常熟市斯泰普新材料有限公司 | 2023-02-24 | — | — | CN | claimed |
| CN-115286799-A | Triblock polysiloxane quaternary ammonium salt and preparation method thereof | 常熟市斯泰普新材料有限公司 | 2022-11-04 | — | — | CN | claimed |
| EP-0230068-B1 | USE OF A GEMINAL DIPHOSPHONIC ACID COMPOUND TO PREPARE A MEDICAMENT | Norwich Eaton Pharmaceuticals, Inc. (US) | 1992-07-15 | — | — | EP | claimed |
| US-20240252473-A1 | Sulfoximines as inhibitors of NaV1.8 | GRUENENTHAL GMBH (DE) | 2024-08-01 | — | — | US | disclosed |
| WO-2024130673-A1 | POLYMER AND PREPARATION METHOD THEREFOR | 深圳华大生命科学研究院 | 2024-06-27 | — | — | WO | disclosed |
| CN-112638910-B | New heterocyclic amine derivatives and pharmaceutical compositions containing the same | 株式会社大熊制药 | 2024-06-11 | — | — | CN | disclosed |
| WO-2024103400-A1 | POLYCYCLIC COMPOUND AS GPR75 ACTIVATOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF | 水木未来(北京)科技有限公司 | 2024-05-23 | — | — | WO | disclosed |
| CN-117466884-A | Heterocyclic compounds or salts thereof as ATR kinase inhibitors, pharmaceutical compositions containing same and uses thereof | 德州大学系统董事会 | 2024-01-30 | — | — | CN | disclosed |
| EP-3846793-B1 | EIF4E INHIBITORS AND USES THEREOF | PIC THERAPEUTICS INC (US) | 2024-01-24 | — | — | EP | disclosed |
| EP-3651768-B1 | HETEROCYCLIC INHIBITORS OF ATR KINASE | UNIV TEXAS (US) | 2023-12-20 | — | — | EP | disclosed |
| WO-2023234759-A1 | NOVEL SULFANONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND USE THEREOF | 한국과학기술연구원 | 2023-12-07 | — | — | WO | disclosed |
| EP-0232623-A1 | 1-Carbacephalosporin antibiotics | ELI LILLY AND COMPANY (US) | 1987-08-19 | — | — | EP | disclosed |
| US-4642341-A | BACTERICIDES | BRISTOL-MYERS COMPANY (US) | 1987-02-10 | — | — | US | disclosed |
| EP-0209751-A2 | Cephalosporin derivatives and bactericides containing the same | MEIJI SEIKA KAISHA LTD. (JP) | 1987-01-28 | — | — | EP | disclosed |
| US-4568682-A | Certain N-lower-alkyl-2-(pyridin-3yl)-tetrahydrothiophene or tetrahydrothiopyran-2-carbothioamide-1-oxides having anti-hypertensive activity | RHONE-POULENC SANTE (FR) | 1986-02-04 | — | — | US | disclosed |
| US-4552696-A | GRAMNEGATIVE AND GRAMPOSITIVE BATERIA | BRISTOL-MYERS COMPANY (US) | 1985-11-12 | — | — | US | disclosed |
| US-4474954-A | Intermediates for cephalosporin derivatives | BRISTOL-MYERS COMPANY (US) | 1984-10-02 | — | — | US | disclosed |
| US-4394503-A | BACTERICIDWS | BRISTOL-MYERS COMPANY (US) | 1983-07-19 | — | — | US | disclosed |
| US-4315005-A | Cephalosporin antibiotics | GLAXO GROUP LIMITED (GB) | 1982-02-09 | — | — | US | disclosed |