⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10316619 | 0.78 | — | — | |
| SCHEMBL3856006 | 0.77 | — | — | |
| SCHEMBL15939345 | 0.74 | — | — | |
| SCHEMBL7758105 | 0.63 | — | — | |
| SCHEMBL10011315 | 0.63 | TP53 (0.38) | — | |
| SCHEMBL10012514 | 0.62 | ALDH1A1 (0.40) | — | |
| SCHEMBL9591961 | 0.62 | — | — | |
| SCHEMBL7243114 | 0.62 | — | — | |
| SCHEMBL7245640 | 0.62 | — | — | |
| SCHEMBL17263339 | 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
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7588334-B2 | Contact lens | MENICON CO., LTD. (JP) | 2009-09-15 | — | — | US | disclosed |
| US-20070232755-A1 | Contact Lens | MENICON CO., LTD. (JP) | 2007-10-04 | — | — | US | disclosed |