⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL272770 | 0.97 | — | — | |
| SCHEMBL28135308 | 0.95 | — | — | |
| SCHEMBL9003013 | 0.95 | MEN1 (0.40) | — | |
| SCHEMBL31677431 | 0.93 | MEN1 (0.39) | — | |
| SCHEMBL10031349 | 0.93 | MEN1 (0.39) | — | |
| SCHEMBL31357443 | 0.91 | MEN1 (0.38) | — | |
| SCHEMBL32682138 | 0.91 | MEN1 (0.38) | — | |
| SCHEMBL30098395 | 0.91 | MEN1 (0.38) | — | |
| SCHEMBL6941611 | 0.91 | POLB (0.38) | — | |
| SCHEMBL29714317 | 0.91 | MEN1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105968338-B | α-phenylalkyl alcohol polyoxyethylene ether hydroxypropyl allyl ether and its derivative and preparation method | 南通市晗泰化工有限公司 | 2018-08-07 | — | — | CN | disclosed |
| CN-105968338-A | Alpha-phenyl alkyl alcohol polyoxyethylene ether hydroxypropyl allyl ether as well as derivative and preparation method thereof | 南通市晗泰化工有限公司 | 2016-09-28 | — | — | CN | disclosed |