⚠ 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 | |
|---|---|---|---|---|
| Styrene SCHEMBL6858832 | 0.85 | MEN1 (0.32) | — | |
| SCHEMBL2773963 | 0.84 | MAPT (0.35) | — | |
| SCHEMBL6367955 | 0.84 | ADORA3 (0.30) | — | |
| SCHEMBL7269137 | 0.83 | LMNA (0.34) | — | |
| SCHEMBL7251880 | 0.83 | KDM4E (0.30) | — | |
| SCHEMBL6357418 | 0.83 | ADORA3 (0.31) | — | |
| SCHEMBL7257971 | 0.83 | — | — | |
| SCHEMBL2771513 | 0.80 | ABL1 (0.37) | — | |
| SCHEMBL7252803 | 0.79 | CTSL (0.32) | — | |
| 4-Vinylphenol SCHEMBL28475101 | 0.76 | CA12 (0.33) | — |
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-7267923-B2 | Resist composition and patterning process | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2007-09-11 | — | — | US | disclosed |