⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4265532 | 0.81 | — | — | |
| SCHEMBL8078444 | 0.81 | KMT2A (0.50) | — | |
| SCHEMBL11131196 | 0.81 | KMT2A (0.50) | — | |
| Acetone SCHEMBL28364608 | 0.74 | KDM4E (0.43) | — | |
| SCHEMBL15789558 | 0.74 | KMT2A (0.71) | — | |
| SCHEMBL15789560 | 0.74 | KMT2A (0.71) | — | |
| SCHEMBL1276454 | 0.73 | KMT2A (0.65) | — | |
| SCHEMBL4600199 | 0.73 | — | — | |
| SCHEMBL16970362 | 0.73 | — | — | |
| SCHEMBL957232 | 0.73 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4272761-A2 | COMPOSITIONS FOR TREATING OPHTHALMIC CONDITIONS | Medicon Pharmaceuticals, Inc. (US) | 2023-11-08 | — | — | EP | disclosed |
| EP-1495018-B3 | TRICYCLIC THROMBIN RECEPTOR ANTAGONISTS | SCHERING CORP (US) | 2011-03-16 | — | — | EP | disclosed |
| US-4833146-A | BRAINS, BLOOD DISORDERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-05-23 | — | — | US | disclosed |
| EP-0268585-A1 | TERTIARY HYDROXYALKYLXANTHINES, THEIR MANUFACTURING PROCESS, MEDICINES CONTAINING THEM AND USE THEREOF. | HOECHST AG (DE) | 1988-06-01 | — | — | EP | disclosed |
| WO-1987000523-A2 | TERTIARY HYDROXYALKYLXANTHINES, THEIR MANUFACTURING PROCESS, MEDICINES CONTAINING THEM AND USE THEREOF | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-01-29 | — | — | WO | disclosed |