⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9422164 | 0.98 | — | — | |
| SCHEMBL815060 | 0.79 | HTR6 (0.33) | — | |
| SCHEMBL7026625 | 0.76 | SIGMAR1 (0.32) | — | |
| SCHEMBL144110 | 0.72 | HTR2A (0.34) | — | |
| SCHEMBL29474419 | 0.72 | HTR2A (0.34) | — | |
| SCHEMBL30637671 | 0.72 | HTR2A (0.34) | — | |
| Hydrochloric Acid SCHEMBL5839045 | 0.70 | HTR2A (0.33) | — | |
| Hydrochloric Acid SCHEMBL60271 | 0.70 | HTR2A (0.33) | — | |
| Methane SCHEMBL5838214 | 0.70 | HTR2A (0.33) | — | |
| Chloromethane SCHEMBL3682989 | 0.69 | HTR6 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1597632-B1 | NON-MAGNETIC MONOCOMPONENT POSITIVE TONER COMPOSITION HAVING SUPERIOR TRANSFER EFFICIENCY | LG CHEMICAL LTD (KR) | 2013-03-27 | — | — | EP | claimed |
| EP-0615981-B1 | Supported catalyst system, its preparation and its use in olefin polymerisation | TARGOR GMBH (DE) | 1998-05-06 | — | — | EP | claimed |
| EP-0610852-B1 | Process for preparing cyclo-olefin polymers | HOECHST AG (DE) | 1997-05-07 | — | — | EP | claimed |
| US-6239187-B1 | 0.1-100% OF POLYMERIZED UNITS DERIVED FROM ONE OR MORE POLYCYCLIC OLEFINS HAVING ONE OR MORE NORBORNENE UNITS AND 0-99% OF POLYMERIZED UNITS DERIVED FROM ONE OR MORE ACYCLIC OLEFINS | TICONA GMBH (DE) | 2001-05-29 | — | — | US | disclosed |