⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16440379 | 0.85 | ALDH1A1 (0.33) | — | |
| SCHEMBL19458016 | 0.81 | ALDH1A1 (0.50) | — | |
| SCHEMBL4854317 | 0.72 | — | — | |
| SCHEMBL5613311 | 0.72 | — | — | |
| SCHEMBL8865499 | 0.69 | — | — | |
| SCHEMBL986762 | 0.67 | DGAT1 (0.50) | — | |
| SCHEMBL4857903 | 0.67 | — | — | |
| SCHEMBL4853948 | 0.67 | — | — | |
| SCHEMBL52 | 0.61 | CA2 (0.35) | — | |
| SCHEMBL65267 | 0.61 | ELANE (0.40) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3231795-B1 | METHOD FOR PREPARING 2,5-DISUBSTITUTED FURAN COMPOUND | NINGBO INST MATERIALS TECH & ENG CAS (CN) | 2021-09-15 | — | — | EP | claimed |
| CN-112409305-A | Preparation method of 2, 5-diacyl furan compound | 中国科学院宁波材料技术与工程研究所 | 2021-02-26 | — | — | CN | claimed |
| US-10125110-B2 | Method for preparing 2,5-disubstituted furan compound | NINGBO INSTITUTE OF MATERIALS TECHNOLOGY & ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) | 2018-11-13 | — | — | US | claimed |
| US-20170320844-A1 | METHOD FOR PREPARING 2,5-DISUBSTITUTED FURAN COMPOUND | NINGBO INSTITUTE OF MATERIALS TECHNOLOGY & ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) | 2017-11-09 | — | — | US | claimed |
| CN-112409305-A | Preparation method of 2, 5-diacyl furan compound | 中国科学院宁波材料技术与工程研究所 | 2021-02-26 | — | — | CN | disclosed |
| US-10125110-B2 | Method for preparing 2,5-disubstituted furan compound | NINGBO INSTITUTE OF MATERIALS TECHNOLOGY & ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) | 2018-11-13 | — | — | US | disclosed |
| US-20170320844-A1 | METHOD FOR PREPARING 2,5-DISUBSTITUTED FURAN COMPOUND | NINGBO INSTITUTE OF MATERIALS TECHNOLOGY & ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) | 2017-11-09 | — | — | US | disclosed |
| EP-3231795-A1 | METHOD FOR PREPARING 2,5-DISUBSTITUTED FURAN COMPOUND | Ningbo Institute Of Material Technology And Engineering Chinese Academy of Sciences (CN) | 2017-10-18 | — | — | EP | disclosed |