⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7169842 | 0.95 | DAO (0.31) | — | |
| SCHEMBL85907 | 0.90 | — | — | |
| SCHEMBL3663785 | 0.81 | — | — | |
| SCHEMBL13881290 | 0.75 | — | — | |
| SCHEMBL17572317 | 0.75 | — | — | |
| SCHEMBL17147691 | 0.75 | — | — | |
| SCHEMBL1192447 | 0.75 | — | — | |
| SCHEMBL19217734 | 0.74 | DAO (0.35) | — | |
| SCHEMBL1802734 | 0.74 | DAO (0.35) | — | |
| SCHEMBL13662108 | 0.73 | NSD2 (0.35) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1996194-B1 | HOMOTROPANES WITH CENTRAL NERVOUS SYSTEM ACTIVITY | UNIV NEW YORK STATE RES FOUND (US) | 2011-03-09 | — | — | EP | disclosed |
| US-7550588-B2 | Homotropanes with central nervous system activity | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 2009-06-23 | — | — | US | disclosed |
| EP-1996194-A2 | HOMOTROPANES WITH CENTRAL NERVOUS SYSTEM ACTIVITY | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 2008-12-03 | — | — | EP | disclosed |
| US-20070232587-A1 | Homotropanes with central nervous system activity | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2007-10-04 | — | — | US | disclosed |
| WO-2007106439-A2 | HOMOTROPANES WITH CENTRAL NERVOUS SYSTEM ACTIVITY | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 2007-09-20 | — | — | WO | disclosed |