⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31337705 | 0.78 | MGAM (0.48) | — | |
| SCHEMBL7055838 | 0.78 | — | — | |
| Acetic Acid SCHEMBL5674100 | 0.78 | ALDH1A1 (0.42) | — | |
| SCHEMBL11520378 | 0.78 | — | — | |
| SCHEMBL5713423 | 0.78 | — | — | |
| SCHEMBL1768269 | 0.77 | — | — | |
| SCHEMBL3203550 | 0.77 | ALDH1A1 (0.46) | — | |
| SCHEMBL1825295 | 0.76 | — | — | |
| SCHEMBL11363953 | 0.75 | ALDH1A1 (0.44) | — | |
| SCHEMBL2701192 | 0.72 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210289794-A1 | COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE | FLAGSHIP PIONEERING INNOVATIONS V, INC. | 2021-09-23 | — | — | US | disclosed |
| CN-107207996-A | Cleasing compositions and forming method thereof | 巴斯夫欧洲公司 | 2017-09-26 | — | — | CN | disclosed |
| WO-2014084743-A1 | DENDRITIC CORE COMPOUNDS | CALLAGHAN INNOVATION RESEARCH LIMITED (NZ) | 2014-06-05 | — | — | WO | disclosed |
| CN-102781909-A | N-alkoxyamide conjugates as imaging agents | LANTHEUS MEDICAL IMAGING INC | 2012-11-14 | — | — | CN | disclosed |
| EP-1347784-A2 | SIMULTANEOUS DUAL ISOTOPE IMAGING OF CARDIAC PERFUSION AND CARDIAC INFLAMMATION | Bristol-Myers Squibb Pharma Company (US) | 2003-10-01 | — | — | EP | disclosed |
| WO-2002036173-A2 | SIMULTANEOUS DUAL ISOTOPE IMAGING OF CARDIAC PERFUSION AND CARDIAC INFLAMMATION | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2002-05-10 | — | — | WO | disclosed |