⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9602849 | 0.88 | MEN1 (0.35) | — | |
| SCHEMBL9808321 | 0.76 | GRIN2D (0.47) | — | |
| SCHEMBL9602543 | 0.76 | GRIN2D (0.47) | — | |
| SCHEMBL9602427 | 0.72 | — | — | |
| SCHEMBL10963921 | 0.71 | — | — | |
| SCHEMBL17231979 | 0.71 | — | — | |
| SCHEMBL4575714 | 0.69 | THRB (0.54) | — | |
| SCHEMBL1577091 | 0.69 | PPM1B (0.36) | — | |
| SCHEMBL29041638 | 0.69 | PPM1B (0.36) | — | |
| SCHEMBL3664884 | 0.69 | PPM1B (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5217963-A | Antiischemic, antiepileptic agent | CIBA-GEIGY CORPORATION (US) | 1993-06-08 | — | — | US | disclosed |
| US-5057506-A | Anticonvulsants, antispasmodic and antischemic agents | CIBA-GEIGY CORPORATION (US) | 1991-10-15 | — | — | US | disclosed |
| US-4906621-A | Certain 2-carboxypiperidyl-alkylene phosphonic acids and esters thereof useful for the treatment of disorders responsive to N-methyl-D-aspartate receptor blockade | CIBA-GEIGY CORPORATION (US) | 1990-03-06 | — | — | US | disclosed |