⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4866479 | 1.00 | — | — | |
| SCHEMBL12858372 | 1.00 | — | — | |
| SCHEMBL8762992 | 0.73 | — | — | |
| SCHEMBL10492901 | 0.73 | — | — | |
| SCHEMBL27858722 | 0.73 | — | — | |
| SCHEMBL7708726 | 0.73 | — | — | |
| SCHEMBL8324142 | 0.71 | — | — | |
| SCHEMBL105998 | 0.71 | FFAR3 (0.55) | — | |
| SCHEMBL141678 | 0.71 | FFAR3 (0.55) | — | |
| SCHEMBL10661623 | 0.71 | FFAR3 (0.55) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023033519-A1 | NANOMACHINERY FOR PREVENTION OR TREATMENT OF CANCER | 울산과학기술원 | 2023-03-09 | — | — | WO | disclosed |
| US-20080125310-A1 | Hydride reduction of alpha, beta-unsaturated carbonyl compounds using chiral organic catalysts | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2008-05-29 | — | — | US | disclosed |
| US-7323604-B2 | Hydride reduction of α,β-unsaturated carbonyl compounds using chiral organic catalysts | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2008-01-29 | — | — | US | disclosed |
| US-20060161024-A1 | Hydride reduction of alpha, beta-unsaturated carbonyl compounds using chiral organic catalysts | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2006-07-20 | — | — | US | disclosed |
| EP-1200499-B1 | ORGANIC POLYMERS | NOVARTIS AG (CH) | 2004-10-06 | — | — | EP | disclosed |
| US-6734281-B2 | Organic polymers | NOVARTIS AG (CH) | 2004-05-11 | — | — | US | disclosed |
| US-6715874-B1 | CROSSLINKABLE AMPHIPHILIC BLOCK COPOLYMERS, WITHIN THE APPLICATION ALSO CALLED PREPOLYMERS, WHICH ARE BASED ON EASILY ACCESSIBLE HYDROPHILIC BLOCKS WITH HIGH VARIABILITY OF CHEMICAL CONSTITUTION AND SEGMENTAL LENGTH | NOVARTIS AG (CH) | 2004-04-06 | — | — | US | disclosed |
| US-20020149740-A1 | Organic polymers | ALCON INC. (CH) | 2002-10-17 | — | — | US | disclosed |