⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22144462 | 0.73 | — | — | |
| SCHEMBL6006346 | 0.67 | CES2 (0.40) | — | |
| SCHEMBL6144841 | 0.64 | — | — | |
| SCHEMBL9134442 | 0.64 | TRIM24 (0.43) | — | |
| SCHEMBL18721774 | 0.63 | MAOA (0.46) | — | |
| SCHEMBL4620400 | 0.61 | TRIM24 (0.40) | — | |
| SCHEMBL18255829 | 0.61 | TRIM24 (0.50) | — | |
| SCHEMBL10611674 | 0.61 | TRIM24 (0.50) | — | |
| SCHEMBL7547316 | 0.60 | — | — | |
| SCHEMBL887270 | 0.60 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8197722-B2 | Irradiating the compound (containing two electron donor groups and a bridge of pi-conjugated bonds containing electron donor groups) with light, and the compound is converted to a multi-photon electronically excited state | THE CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2012-06-12 | — | — | US | disclosed |