⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2852291 | 0.81 | CHRNB2 (0.30) | — | |
| SCHEMBL302005 | 0.72 | — | — | |
| SCHEMBL27526976 | 0.71 | MAPT (0.30) | — | |
| Hydrochloric Acid SCHEMBL8122291 | 0.71 | — | — | |
| Cyclohexanone SCHEMBL28357381 | 0.68 | TRIM24 (0.34) | — | |
| SCHEMBL23181453 | 0.68 | — | — | |
| SCHEMBL30572434 | 0.68 | — | — | |
| SCHEMBL7135080 | 0.68 | — | — | |
| SCHEMBL3293899 | 0.68 | MAPT (0.42) | — | |
| SCHEMBL9828424 | 0.67 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5461156-A | Stereocontrolled synthesis of cis-bicyclic compounds | ELI LILLY AND COMPANY (US) | 1995-10-24 | — | — | US | disclosed |
| US-5461156-A | Stereocontrolled synthesis of cis-bicyclic compounds | ELI LILLY AND COMPANY (US) | 1995-10-24 | — | — | US | disclosed |
| EP-0618196-A1 | Stereocontrolled synthesis of cis-bicyclic compounds | ELI LILLY AND COMPANY (US) | 1994-10-05 | — | — | EP | disclosed |
| EP-0618196-A1 | Stereocontrolled synthesis of cis-bicyclic compounds | ELI LILLY AND COMPANY (US) | 1994-10-05 | — | — | EP | disclosed |
| US-4758262-A | Substituted with phenyl ring | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1988-07-19 | — | — | US | disclosed |
| EP-0190945-A2 | Herbicidal propylene oxide derivatives | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1986-08-13 | — | — | EP | disclosed |