⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7086744 | 0.82 | — | — | |
| SCHEMBL6977673 | 0.77 | — | — | |
| SCHEMBL5065484 | 0.77 | — | — | |
| SCHEMBL6535088 | 0.73 | CYP2D6 (0.33) | — | |
| SCHEMBL7265567 | 0.73 | CYP2D6 (0.33) | — | |
| SCHEMBL6883591 | 0.68 | NPC1 (0.39) | — | |
| SCHEMBL9718812 | 0.67 | HPGD (0.38) | — | |
| SCHEMBL5064867 | 0.67 | — | — | |
| SCHEMBL5064167 | 0.67 | — | — | |
| SCHEMBL8906766 | 0.66 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120277420-A1 | REFINED ROUTES TO CHLORIN BUILDING BLOCKS | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2012-11-01 | — | — | US | disclosed |
| US-8212055-B2 | Refined routes to chlorin building blocks | NORTH CAROLINA STATE UNIVERSITY (US) | 2012-07-03 | — | — | US | disclosed |
| US-20100204465-A1 | REFINED ROUTES TO CHLORIN BUILDING BLOCKS | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2010-08-12 | — | — | US | disclosed |
| US-7678900-B2 | Refined routes to chlorin building blocks | NORTH CAROLINA STATE UNIVERSITY (US) | 2010-03-16 | — | — | US | disclosed |
| US-20090069558-A1 | REFINED ROUTES TO CHLORIN BUILDING BLOCKS | NORTH CAROLINA STATE UNIVERSITY (US) | 2009-03-12 | — | — | US | disclosed |
| US-7470785-B2 | Refined routes to chlorin building blocks | NORTH CAROLINA STATE UNIVERSITY (US) | 2008-12-30 | — | — | US | disclosed |
| US-6946552-B2 | Refined routes to chlorin building blocks | NORTH CAROLINA STATE UNIVERSITY (US) | 2005-09-20 | — | — | US | disclosed |
| US-20050165228-A1 | Refined routes to chlorin building blocks | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2005-07-28 | — | — | US | disclosed |
| US-20030096989-A1 | Refined routes to chlorin building blocks | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2003-05-22 | — | — | US | disclosed |