⚠ 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 | |
|---|---|---|---|---|
| Methane SCHEMBL27373472 | 0.98 | CTSD (0.30) | — | |
| Methane SCHEMBL27443294 | 0.95 | — | — | |
| SCHEMBL27894201 | 0.95 | CTSD (0.31) | — | |
| SCHEMBL8853537 | 0.75 | CTSD (0.31) | — | |
| SCHEMBL2917335 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL5888449 | 0.73 | CTSD (0.30) | — | |
| SCHEMBL28265464 | 0.72 | CTSD (0.32) | — | |
| Hydrochloric Acid SCHEMBL5888446 | 0.68 | CTSD (0.30) | — | |
| Hydrochloric Acid SCHEMBL8846337 | 0.68 | CTSD (0.30) | — | |
| Hydrochloric Acid SCHEMBL8379012 | 0.68 | CTSD (0.30) | — |
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-1152062-C | Olefin solution polymerization | �Ϻ���ͨ��ѧ | 2004-06-02 | — | — | CN | disclosed |
| CN-1219178-A | Olefin solution polymerization | DOW CHEMICAL CO (US) | 1999-06-09 | — | — | CN | disclosed |