⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2851395 | 0.78 | — | — | |
| SCHEMBL50593 | 0.73 | — | — | |
| Pyridine SCHEMBL3395217 | 0.71 | TSHR (0.33) | — | |
| SCHEMBL217284 | 0.69 | — | — | |
| Bromide SCHEMBL28508208 | 0.67 | NFKB1 (0.43) | — | |
| Dimethylformamide SCHEMBL3299693 | 0.63 | TSHR (0.36) | — | |
| Pyridine SCHEMBL6905947 | 0.60 | TSHR (0.41) | — | |
| 1-Methylimidazole SCHEMBL29178524 | 0.60 | NFKB1 (0.68) | — | |
| SCHEMBL17128637 | 0.59 | NFKB1 (0.36) | — | |
| SCHEMBL10503985 | 0.57 | NFKB1 (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5620690-A | CONTAINING STEROL, SAPONIN AND PHOSPHOLIPID | DE STAT DER NEDERLANDEN VERTEGENWOORDIGD DOOR DE MINISTER VAN WELZIJN VOLKSGEZONDHEID EN CULTUUR (NL) | 1997-04-15 | — | — | US | disclosed |
| EP-0555276-B1 | IMMUNOGENIC COMPLEXES, IN PARTICULAR ISCOMS | NEDERLANDEN STAAT (NL) | 1995-08-30 | — | — | EP | disclosed |
| EP-0555276-A1 | IMMUNOGENIC COMPLEXES, IN PARTICULAR ISCOMS. | NEDERLANDEN STAAT (NL) | 1993-08-18 | — | — | EP | disclosed |
| WO-1992006710-A1 | IMMUNOGENIC COMPLEXES, IN PARTICULAR ISCOMS | DE STAAT DER NEDERLANDEN VERTEGENWOORDIGD DOOR DE MINISTER VAN WELZIJN VOLKSGEZONDHEID EN CULTUUR (NL) | 1992-04-30 | — | — | WO | disclosed |