⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18260304 | 0.90 | GRIN2D (0.33) | — | |
| SCHEMBL678309 | 0.87 | — | — | |
| SCHEMBL13383478 | 0.86 | ALDH1A1 (0.32) | — | |
| SCHEMBL22266852 | 0.86 | ALDH1A1 (0.32) | — | |
| SCHEMBL15281489 | 0.86 | ALDH1A1 (0.32) | — | |
| SCHEMBL6559178 | 0.86 | ALDH1A1 (0.32) | — | |
| SCHEMBL31661874 | 0.86 | ALDH1A1 (0.32) | — | |
| SCHEMBL74718 | 0.86 | ALDH1A1 (0.32) | — | |
| SCHEMBL678036 | 0.84 | MEN1 (0.36) | — | |
| SCHEMBL678287 | 0.83 | — | — |
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-8129100-B2 | Double patterning process | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2012-03-06 | — | — | US | disclosed |
| US-20090253084-A1 | DOUBLE PATTERNING PROCESS | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2009-10-08 | — | — | US | disclosed |