⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4260285 | 0.89 | KDM4E (0.30) | — | |
| SCHEMBL27949938 | 0.87 | KDM4E (0.30) | — | |
| SCHEMBL28466365 | 0.81 | KDM4E (0.31) | — | |
| SCHEMBL78094 | 0.80 | — | — | |
| SCHEMBL1673912 | 0.78 | — | — | |
| SCHEMBL12988422 | 0.77 | — | — | |
| SCHEMBL2064910 | 0.76 | KDM4E (0.39) | — | |
| SCHEMBL28476969 | 0.75 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL2790799 | 0.75 | KMT2A (0.38) | — | |
| SCHEMBL2787418 | 0.74 | RXRA (0.32) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6849730-B2 | Methods of making porphyrins and related compounds with Lewis acids | NORTH CAROLINA STATE UNIVERSITY (US) | 2005-02-01 | — | — | US | disclosed |
| US-20030096978-A1 | Methods of making porphyrins and related compounds with Lewis acids | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2003-05-22 | — | — | US | disclosed |