Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6543264 | 0.80 | — | — | |
| 2-Pyrrolidone SCHEMBL867929 | 0.67 | OR51E2 (0.34) | — | |
| SCHEMBL5807968 | 0.65 | — | — | |
| SCHEMBL7623204 | 0.64 | KDM4E (0.31) | — | |
| SCHEMBL9146682 | 0.64 | — | — | |
| SCHEMBL5162598 | 0.63 | ALDH1A1 (0.44) | — | |
| SCHEMBL9331484 | 0.63 | LMNA (0.30) | — | |
| SCHEMBL9190091 | 0.62 | RECQL (0.34) | — | |
| Pentadecane SCHEMBL9190986 | 0.62 | RECQL (0.34) | — | |
| SCHEMBL1502246 | 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 |
|---|---|---|---|---|---|---|---|
| EP-0715843-A1 | Quaternized copolymers as agents in cosmetic preparations for hair styling aid | BASF AKTIENGESELLSCHAFT (DE) | 1996-06-12 | — | — | EP | disclosed |