⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9481458 | 0.72 | — | — | |
| SCHEMBL21490432 | 0.72 | CHKA (0.56) | — | |
| SCHEMBL904427 | 0.72 | — | — | |
| SCHEMBL10044408 | 0.72 | — | — | |
| SCHEMBL22228647 | 0.72 | RAPGEF4 (0.39) | — | |
| SCHEMBL41775 | 0.71 | TSHR (0.67) | — | |
| Hydrochloric Acid SCHEMBL10766835 | 0.69 | TSHR (0.42) | — | |
| SCHEMBL294241 | 0.69 | CHKA (0.52) | — | |
| SCHEMBL31672218 | 0.65 | TSHR (0.59) | — | |
| SCHEMBL92935 | 0.65 | LPL (0.52) | — |
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-4727940-A1 | DIHYDROPYRIMIDINE-2, 4 (1H, 3H) -DIONE-CONTAINING POLYCYCLIC DERIVATIVES AND PHARMACEUTICAL COMPOSITION THEREOF, PREPARATION METHOD THEREOF AND USE THEREOF | Linkcure Therapeutics (KY) | 2026-04-22 | — | — | EP | disclosed |
| WO-2024255810-A1 | DIHYDROPYRIMIDINE-2, 4 (1H, 3H) -DIONE-CONTAINING POLYCYCLIC DERIVATIVES AND PHARMACEUTICAL COMPOSITION THEREOF, PREPARATION METHOD THEREOF AND USE THEREOF | HANGZHOU GLUBIO PHARMACEUTICAL CO., LTD (CN) | 2024-12-19 | — | — | WO | disclosed |
| WO-2020153676-A1 | A FUSED RING HETEROARYL COMPOUND AS AN ALK4/5 INHIBITOR | BISICHEM CO., LTD. (KR) | 2020-07-30 | — | — | WO | disclosed |
| WO-2015066371-A1 | SPIRO-OXADIAZOLINE COMPOUNDS AS AGONISTS OF α-7-NICOTINIC ACETYLCHOLINE RECEPTORS | FORUM PHARMACEUTICALS, INC. (US) | 2015-05-07 | — | — | WO | disclosed |