⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8473040 | 0.88 | — | — | |
| SCHEMBL8478296 | 0.80 | — | — | |
| SCHEMBL8481311 | 0.72 | — | — | |
| SCHEMBL8185624 | 0.56 | — | — | |
| SCHEMBL8504406 | 0.54 | ELANE (0.31) | — | |
| SCHEMBL1837423 | 0.49 | ELANE (0.39) | — | |
| Perflutren SCHEMBL34348 | 0.47 | LMNA (0.43) | — | |
| Perflutren SCHEMBL1446805 | 0.47 | LMNA (0.43) | — | |
| Perflubutane SCHEMBL111514 | 0.47 | LMNA (0.54) | — | |
| Perflubutane SCHEMBL9051673 | 0.47 | 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 2 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 |