⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18116088 | 0.91 | DNM1 (0.36) | — | |
| SCHEMBL9358790 | 0.85 | — | — | |
| SCHEMBL422241 | 0.74 | DNM1 (0.33) | — | |
| SCHEMBL4080294 | 0.70 | ALDH1A1 (0.32) | — | |
| SCHEMBL9950371 | 0.67 | TSHR (0.32) | — | |
| SCHEMBL30238466 | 0.67 | DNM1 (0.38) | — | |
| SCHEMBL11722355 | 0.65 | DNM1 (0.31) | — | |
| SCHEMBL4540167 | 0.65 | LMNA (0.30) | — | |
| SCHEMBL422635 | 0.65 | TSHR (0.42) | — | |
| SCHEMBL7922841 | 0.65 | TSHR (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008027479-A2 | HIGHLY ACTIVE ALPHA-OLEFIN COPOLYMERIZATION CATALYST SYSTEM | FORMOSA PLASTICS CORPORATION, U.S.A. (US) | 2008-03-06 | — | — | WO | disclosed |