⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8018903 | 0.78 | — | — | |
| SCHEMBL9859739 | 0.73 | MMP9 (0.31) | — | |
| SCHEMBL465319 | 0.73 | — | — | |
| SCHEMBL28246274 | 0.72 | TSHR (0.31) | — | |
| SCHEMBL22618285 | 0.71 | — | — | |
| Ethylene SCHEMBL20495562 | 0.71 | GRIK1 (0.31) | — | |
| SCHEMBL6666648 | 0.71 | FPR2 (0.35) | — | |
| SCHEMBL6932516 | 0.71 | PTGS1 (0.30) | — | |
| SCHEMBL835461 | 0.69 | ALDH1A1 (0.30) | — | |
| SCHEMBL9580842 | 0.68 | — | — |
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-8623980-B2 | Process for making a saturated dendritic hydrocarbon polymer | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2014-01-07 | — | — | US | disclosed |
| US-20120157633-A1 | PROCESS FOR MAKING A SATURATED DENDRITIC HYDROCARBON POLYMER | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2012-06-21 | — | — | US | disclosed |