⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8366699 | 0.71 | — | — | |
| SCHEMBL14914735 | 0.71 | — | — | |
| SCHEMBL14915497 | 0.69 | — | — | |
| SCHEMBL6538151 | 0.65 | — | — | |
| SCHEMBL431934 | 0.61 | — | — | |
| SCHEMBL1238338 | 0.59 | — | — | |
| SCHEMBL4059820 | 0.59 | — | — | |
| SCHEMBL4362207 | 0.58 | — | — | |
| SCHEMBL641601 | 0.57 | TSHR (0.32) | — | |
| SCHEMBL9816014 | 0.56 | — | — |
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-5294354-A | Polyethylene grafted with an unsaturated nitrogen-containing heterocyclic compound and an overbased oil soluble calcium sulfonate | TEXACO INC. (US) | 1994-03-15 | — | — | US | claimed |
| US-5294354-A | Polyethylene grafted with an unsaturated nitrogen-containing heterocyclic compound and an overbased oil soluble calcium sulfonate | TEXACO INC. (US) | 1994-03-15 | — | — | US | disclosed |