⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6799 | 0.73 | — | — | |
| SCHEMBL8769369 | 0.71 | — | — | |
| SCHEMBL22557595 | 0.71 | — | — | |
| SCHEMBL1173849 | 0.71 | — | — | |
| SCHEMBL1767599 | 0.69 | — | — | |
| SCHEMBL15802701 | 0.69 | — | — | |
| SCHEMBL15802700 | 0.69 | — | — | |
| SCHEMBL2147888 | 0.69 | — | — | |
| Ethylene SCHEMBL27730022 | 0.69 | — | — | |
| SCHEMBL30154499 | 0.67 | TDP1 (0.30) | — |
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-6072063-A | Low-melting ester quats | CLARIANT GMBH (DE) | 2000-06-06 | — | — | US | claimed |
| EP-2426154-A1 | Photosensitive composition, pattern forming method using the photosensitive composition and compound for use in the photosensitive composition | Fujifilm Corporation (JP) | 2012-03-07 | — | — | EP | disclosed |