⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5565745 | 0.88 | KDM4E (0.31) | — | |
| Hydrochloric Acid SCHEMBL2258996 | 0.87 | FDPS (0.32) | — | |
| Hydrochloric Acid SCHEMBL2266110 | 0.76 | ACP3 (0.35) | — | |
| Trifluoromethanesulfonamide SCHEMBL3260193 | 0.74 | LMNA (0.32) | — | |
| Hydrochloric Acid SCHEMBL3930213 | 0.73 | FDPS (0.32) | — | |
| Trifluoromethanesulfonamide SCHEMBL3994265 | 0.72 | — | — | |
| Trifluoromethanesulfonamide SCHEMBL2489847 | 0.72 | ALDH1A1 (0.48) | — | |
| SCHEMBL1226946 | 0.71 | ACP3 (0.35) | — | |
| SCHEMBL4330742 | 0.70 | MMP8 (0.37) | — | |
| Bromide SCHEMBL1227449 | 0.70 | LMNA (0.36) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090259042-A1 | ELECTROCHROMIC COMPOUNDS | NTERA LIMITED (IE) | 2009-10-15 | — | — | US | claimed |
| US-20060110638-A1 | Electrochromic compounds | NTERA LIMITED (IE) | 2006-05-25 | — | — | US | claimed |
| EP-1443091-A1 | Electrochromic compounds | Ntera Limited (IE) | 2004-08-04 | — | — | EP | claimed |
| US-20090259042-A1 | ELECTROCHROMIC COMPOUNDS | NTERA LIMITED (IE) | 2009-10-15 | — | — | US | disclosed |
| US-7567371-B2 | Electrochromic compounds | NTERA LIMITED (IE) | 2009-07-28 | — | — | US | disclosed |
| US-20060110638-A1 | Electrochromic compounds | NTERA LIMITED (IE) | 2006-05-25 | — | — | US | disclosed |
| EP-1443091-A1 | Electrochromic compounds | Ntera Limited (IE) | 2004-08-04 | — | — | EP | disclosed |