⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2197286 | 0.81 | — | — | |
| SCHEMBL8950137 | 0.80 | ALDH1A1 (0.32) | — | |
| SCHEMBL9746470 | 0.79 | — | — | |
| SCHEMBL9245904 | 0.77 | PLA2G1B (0.32) | — | |
| SCHEMBL6033701 | 0.77 | SPHK1 (0.42) | — | |
| SCHEMBL711528 | 0.72 | GABRR1 (0.33) | — | |
| SCHEMBL16798165 | 0.71 | — | — | |
| SCHEMBL3685833 | 0.71 | — | — | |
| SCHEMBL22609036 | 0.69 | — | — | |
| SCHEMBL11001138 | 0.68 | GABRR1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0595364-B1 | Benz[e]indene derivatives and a process for preparing them as well as medicaments containing them and the use of them | EGYT GYOGYSZERVEGYESZETI GYAR (HU) | 1996-07-24 | — | — | EP | disclosed |
| US-5439940-A | Sedatives, anticonvulsants; analgesics, cardiotonic agents, antiinflammatory agents | EGIS GYOGYSZERGYAR RT. (HU) | 1995-08-08 | — | — | US | disclosed |
| EP-0595364-A1 | Benz[e]indene derivatives and a process for preparing them as well as medicaments containing them and the use of them | EGIS GYOGYSZERGYAR RT. (HU) | 1994-05-04 | — | — | EP | disclosed |