⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3339135 | 0.89 | — | — | |
| Carbon Monoxide SCHEMBL1401859 | 0.82 | — | — | |
| Formaldehyde SCHEMBL13583983 | 0.82 | — | — | |
| SCHEMBL834024 | 0.72 | — | — | |
| SCHEMBL834023 | 0.72 | — | — | |
| SCHEMBL9247326 | 0.72 | — | — | |
| SCHEMBL9247330 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL17595103 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL7554803 | 0.70 | — | — | |
| SCHEMBL1053000 | 0.69 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-9067286-A | — | — | None | — | — | JP | disclosed |
| EP-3389857-A2 | IRON CARBIDE NANOPARTICLES, METHOD FOR PREPARING SAME AND USE THEREOF FOR HEAT GENERATION | Institut National des Sciences Appliquées de Toulouse (FR) | 2018-10-24 | — | — | EP | disclosed |
| JP-H0967286-A | PENTACYCLOTETRADECADIENE DERIVATIVES AND THEIR PRODUCTION | MARUZEN PETROCHEM CO LTD | 1997-03-11 | — | — | JP | disclosed |
| US-5608131-A | Pentacyclic hydrocarbon compound and halogenated pentacyclic hydrocarbon compound, and preparation processes thereof | MARUZEN PETROCHEMICAL CO., LTD. (JP) | 1997-03-04 | — | — | US | disclosed |