⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9284610 | 1.00 | — | — | |
| SCHEMBL3286849 | 1.00 | — | — | |
| SCHEMBL16977026 | 0.83 | — | — | |
| SCHEMBL10339469 | 0.81 | — | — | |
| SCHEMBL9098453 | 0.81 | — | — | |
| SCHEMBL9094601 | 0.81 | — | — | |
| SCHEMBL5101215 | 0.81 | — | — | |
| SCHEMBL8577452 | 0.81 | — | — | |
| SCHEMBL11911402 | 0.76 | — | — | |
| SCHEMBL1619196 | 0.74 | ALDH1A1 (0.33) | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7700710-B2 | Pyrolytic formation of metallic nanoparticles | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2010-04-20 | — | — | US | disclosed |
| US-7579430-B2 | Polymeric material made from siloxane-acetylene polymer containing metal-acetylene complex | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2009-08-25 | — | — | US | disclosed |
| US-7579424-B2 | Ceramic material made from siloxane-acetylene polymer containing metal-acetylene complex | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2009-08-25 | — | — | US | disclosed |
| US-7576168-B2 | Thermoset material made from siloxane-acetylene polymer containing metal-acetylene complex | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2009-08-18 | — | — | US | disclosed |
| US-20080227624-A1 | PYROLYTIC FORMATION OF METALLIC NANOPARTICLES | THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2008-09-18 | — | — | US | disclosed |
| US-20070073027-A1 | Thermoset material made from siloxane-acetylene polymer containing metal-acetylene complex | THE GOVERNMENT OF THE UNITED STATES, AS RESPRESENTED BY THE SECRETARY OF THE NAVY | 2007-03-29 | — | — | US | disclosed |
| US-20070073038-A1 | Ceramic material made from siloxane-acetylene polymer containing metal-acetylene complex | THE GOVERNMENT OF THE US, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2007-03-29 | — | — | US | disclosed |
| US-20070073036-A1 | Polymeric material made from siloxane-acetylene polymer containing metal-acetylene complex | THE GOVERNMENT OF THE UNITED STATES, AS RESPRESENTED BY THE SECRETARY OF THE NAVY | 2007-03-29 | — | — | US | disclosed |
| US-6967256-B2 | Formation of enediynes by reductive coupling followed by alkyne metathesis | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2005-11-22 | — | — | US | disclosed |
| US-20040215028-A1 | Formation of enediynes by reductive coupling followed by alkyne metathesis | MASSACHUSETTS INSTITUTE OF TECHNOLOGY | 2004-10-28 | — | — | US | disclosed |
| WO-2004026454-A2 | FORMATION OF ENEDIYNES BY REDUCTIVE COUPLING FOLLOWED BY ALKYNE METATHESIS | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2004-04-01 | — | — | WO | disclosed |
| US-5436361-A | Deprotonation using bases with propargyl halides | CLEMSON UNIVERSITY (US) | 1995-07-25 | — | — | US | disclosed |