⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8481311 | 0.89 | — | — | |
| SCHEMBL8474310 | 0.88 | — | — | |
| SCHEMBL8477446 | 0.72 | — | — | |
| SCHEMBL8478296 | 0.70 | — | — | |
| SCHEMBL8831359 | 0.57 | — | — | |
| SCHEMBL8831507 | 0.54 | — | — | |
| SCHEMBL8185624 | 0.49 | — | — | |
| SCHEMBL17413752 | 0.49 | ALDH1A1 (0.33) | — | |
| SCHEMBL8504406 | 0.47 | ELANE (0.31) | — | |
| Perflubutane SCHEMBL9051673 | 0.41 | LMNA (0.54) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5955603-A | Porphyrins and porphyrin synthesis techniques | TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1999-09-21 | — | — | US | disclosed |
| US-5817830-A | Pyrrolic compounds | TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1998-10-06 | — | — | US | disclosed |
| EP-0821686-A4 | NOVEL PORPHYRINS AND PORPHYRIN SYNTHESIS TECHNIQUES | UNIV PENNSYLVANIA (US) | 1998-04-15 | — | — | EP | disclosed |
| EP-0821686-A1 | NOVEL PORPHYRINS AND PORPHYRIN SYNTHESIS TECHNIQUES | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1998-02-04 | — | — | EP | disclosed |
| WO-1996017844-A1 | NOVEL PORPHYRINS AND PORPHYRIN SYNTHESIS TECHNIQUES | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1996-06-13 | — | — | WO | disclosed |