⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7262419 | 0.87 | — | — | |
| SCHEMBL4047408 | 0.81 | — | — | |
| SCHEMBL10471409 | 0.78 | — | — | |
| SCHEMBL7260922 | 0.72 | — | — | |
| SCHEMBL29558782 | 0.71 | — | — | |
| SCHEMBL30089804 | 0.71 | — | — | |
| SCHEMBL4048481 | 0.64 | KDM4E (0.30) | — | |
| SCHEMBL9879792 | 0.62 | PDE4B (0.32) | — | |
| SCHEMBL10002105 | 0.61 | — | — | |
| SCHEMBL7996476 | 0.60 | ALDH1A1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0804439-B1 | BETA, BETA '-DIHYDROXY MESO-SUBSTITUTED CHLORINS, ISOBACTERIOCHLORINS, BACTERIOCHLORINS, AND METHODS FOR MAKING THE SAME FROM BETA ,BETA '-UNSUBSTITUTED TETRAPYRROLIC MACROCYCLES | UNIV BRITISH COLUMBIA (CA) | 2003-09-17 | — | — | EP | disclosed |
| US-5831088-A | OSMYLATION | THE UNIVERSITY OF BRITISH COLUMBIA (CA) | 1998-11-03 | — | — | US | disclosed |
| US-5648485-A | PORPHYRIN COMPOUNDS | UNIVERSITY OF BRITISH COLUMBIA (CA) | 1997-07-15 | — | — | US | disclosed |