⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5160645 | 0.86 | — | — | |
| SCHEMBL5686212 | 0.72 | KDM4E (0.46) | — | |
| Lithium Ion SCHEMBL5165449 | 0.71 | CA1 (0.33) | — | |
| SCHEMBL2905598 | 0.68 | CA1 (0.34) | — | |
| SCHEMBL5163800 | 0.68 | — | — | |
| SCHEMBL5858637 | 0.67 | CA2 (0.36) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL5827967 | 0.65 | ACHE (0.43) | — | |
| SCHEMBL7960061 | 0.65 | MAPT (0.43) | — | |
| SCHEMBL3197380 | 0.65 | PTGS2 (0.38) | — | |
| SCHEMBL5857793 | 0.63 | CA2 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1766474-A2 | PHOTOACTIVE COMPOUNDS | AZ Electronic Materials USA Corp. (US) | 2007-03-28 | — | — | EP | disclosed |
| WO-2005121894-A2 | PHOTOACTIVE COMPOUNDS | AZ ELECTRONICS MATERIALS USA CORP. (DE) | 2005-12-22 | — | — | WO | disclosed |
| US-20050271974-A1 | Photoactive compounds | AZ ELECTRONIC MATERIALS USA CORP. | 2005-12-08 | — | — | US | disclosed |