⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL956270 | 0.78 | SLC6A4 (0.33) | — | |
| SCHEMBL10362 | 0.77 | — | — | |
| SCHEMBL7588439 | 0.70 | GAA (0.42) | — | |
| SCHEMBL18263233 | 0.69 | SLC6A4 (0.31) | — | |
| SCHEMBL28069727 | 0.68 | ENPP3 (0.33) | — | |
| SCHEMBL12312030 | 0.67 | SLC6A3 (0.33) | — | |
| SCHEMBL8048828 | 0.67 | SLC6A3 (0.33) | — | |
| SCHEMBL17835268 | 0.67 | MAPT (0.34) | — | |
| SCHEMBL12488334 | 0.67 | MAPT (0.34) | — | |
| SCHEMBL17835271 | 0.67 | MAPT (0.34) | — |
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-20100160587-A1 | THERMOSETTING RESIN COMPOSITION AND OPTICAL MEMBER USING CURED PRODUCT OF THE THERMOSETTING RESIN COMPOSITION | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2010-06-24 | — | — | US | disclosed |
| EP-2141203-A1 | THERMOSETTING RESIN COMPOSITION AND OPTICAL MEMBER USING CURED PRODUCT OF THE THERMOSETTING RESIN COMPOSITION | Hitachi Chemical Company, Ltd. (JP) | 2010-01-06 | — | — | EP | disclosed |