⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17122406 | 0.85 | WDR5 (0.34) | — | |
| Triethylene Glycol SCHEMBL28474347 | 0.77 | MEN1 (0.69) | — | |
| Di(Hydroxyethyl)Ether SCHEMBL28183107 | 0.77 | TSHR (0.62) | — | |
| SCHEMBL12344055 | 0.76 | — | — | |
| SCHEMBL6543230 | 0.76 | — | — | |
| Triethylene Glycol SCHEMBL5870361 | 0.74 | MEN1 (0.65) | — | |
| SCHEMBL2490961 | 0.72 | — | — | |
| SCHEMBL28201130 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL21640166 | 0.72 | WDR5 (0.32) | — | |
| Hydrochloric Acid SCHEMBL14314282 | 0.70 | — | — |
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-0399856-B1 | Pteridin-4 (3H)-ones, processes for their preparation and medicaments containing them | LIPHA (FR) | 1995-08-09 | — | — | EP | disclosed |
| US-5270465-A | 4(3H)-pteridinone compounds | LIPHA, LYONNAISE INDUSTRILLE PHARMACEUTIQUE (FR) | 1993-12-14 | — | — | US | disclosed |
| US-5167949-A | Antiallergic | LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) | 1992-12-01 | — | — | US | disclosed |
| EP-0399856-A1 | Pteridin-4 (3H)-ones, processes for their preparation and medicaments containing them | LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) | 1990-11-28 | — | — | EP | disclosed |