⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL449218 | 0.92 | — | — | |
| SCHEMBL2255838 | 0.90 | DGKA (0.61) | — | |
| SCHEMBL2258838 | 0.90 | DGKA (0.61) | — | |
| SCHEMBL2256002 | 0.90 | DGKA (0.61) | — | |
| SCHEMBL2255255 | 0.90 | DGKA (0.61) | — | |
| SCHEMBL2218438 | 0.90 | DGKA (0.61) | — | |
| SCHEMBL2254789 | 0.90 | DGKA (0.61) | — | |
| SCHEMBL2259990 | 0.90 | DGKA (0.61) | — | |
| SCHEMBL2255273 | 0.90 | DGKA (0.61) | — | |
| SCHEMBL2221066 | 0.90 | DGKA (0.61) | — |
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 2672 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-117500802-A | LACTIVICIN compounds, their preparation and their use as antibacterial agents | 费多拉制药有限公司 | 2024-02-02 | — | — | CN | claimed |
| CN-116348474-A | Azoline saccharide compound, preparation method and application thereof | 中国科学院上海药物研究所 | 2023-06-27 | — | — | CN | claimed |
| CN-108349886-B | Novel heterocyclic amino acid-containing compound and use thereof | 爱知制钢株式会社 | 2021-05-25 | — | — | CN | claimed |
| CN-112624969-A | Quinoline derivative, preparation method thereof and application thereof in preventing and treating plant viruses and killing bacteria | 南开大学 | 2021-04-09 | — | — | CN | claimed |
| EP-3511003-B1 | CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF | TORAY INDUSTRIES (JP) | 2021-03-03 | — | — | EP | claimed |
| EP-3511002-B1 | CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF | TORAY INDUSTRIES (JP) | 2020-08-19 | — | — | EP | claimed |
| EP-3050877-B1 | CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF | TORAY INDUSTRIES (JP) | 2019-10-30 | — | — | EP | claimed |
| EP-3511002-A1 | CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF | Toray Industries, Inc. (JP) | 2019-07-17 | — | — | EP | claimed |
| EP-3511003-A1 | CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF | Toray Industries, Inc. (JP) | 2019-07-17 | — | — | EP | claimed |
| CN-106554363-B | A kind of preparation method of Baricitinib intermediate | 正大天晴药业集团股份有限公司 | 2019-03-05 | — | — | CN | claimed |
| US-6287648-B1 | MIXTURE OF POLAR COMPOUNDS HAVING POSITIVE DIELECTRIC ANISTROPY | MERCK PATENT GESELLSCHAFT MIT (DE) | 2001-09-11 | — | — | US | claimed |
| EP-1095947-A1 | NOVEL ANTIBACTERIAL COMPOUNDS | Sankyo Company Limited (JP) | 2001-05-02 | — | — | EP | claimed |
| US-6194398-B1 | VIRICIDES AGAINST HUMAN IMMUNODEFICIENCY VIRUS, HERPES SIMPLEX VIRUS, HEPATITIS B VIRUS; ANTITUMOR AGENTS; SIDE EFFECT REDUCTION; ORAL ABSORPTION BIOAVAILABILITY; A 2-AMINO-6-HYDROCARBYLTHIO-9-(2-(PHOSPHONOMETHOXY)ETHYL-9H-PURINE | MITSUBISHI CHEMICAL CORPORATION (JP) | 2001-02-27 | — | — | US | claimed |
| WO-1997048444-A1 | IONTOPHORETIC DELIVERY OF CELL ADHESION INHIBITORS | BECTON DICKINSON AND COMPANY (US) | 1997-12-24 | — | — | WO | claimed |
| EP-0541550-B1 | NEW INTERMEDIATES, THEIR PRODUCTION AND USE | LEO PHARM PROD LTD (DK) | 1994-09-07 | — | — | EP | claimed |
| EP-0250997-B1 | VALPROIC AND (E)-2-VALPROENOIC ACID DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS THEREFROM | CHIESI FARMACEUTICI S.p.A. (IT) | 1992-04-15 | — | — | EP | claimed |
| US-4882338-A | Substituted isoquinoline derivatives and anti-ulcer agents | SHIONOGI & CO., LTD. (JP) | 1989-11-21 | — | — | US | claimed |
| US-4699979-A | 7-amino-3-propenylcephalosporanic acid and esters thereof | BRISTOL-MEYERS COMPANY (US) | 1987-10-13 | — | — | US | claimed |
| US-4406887-A | PENICILLINS AND CEPHALOSPORIN MIXTURES | BRISTOL-MYERS COMPANY (US) | 1983-09-27 | — | — | US | claimed |
| US-4380512-A | INHIBITORS OF 3-LACTAMASES | BRISTOL-MYERS COMPANY (US) | 1983-04-19 | — | — | US | claimed |