⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL226836 | 0.86 | — | — | |
| SCHEMBL11314685 | 0.85 | — | — | |
| SCHEMBL27920656 | 0.85 | — | — | |
| SCHEMBL8846964 | 0.82 | — | — | |
| SCHEMBL28107586 | 0.82 | — | — | |
| SCHEMBL224520 | 0.81 | — | — | |
| SCHEMBL455574 | 0.79 | FGFR1 (0.35) | — | |
| SCHEMBL28169474 | 0.79 | KDM4E (0.33) | — | |
| SCHEMBL28164579 | 0.79 | — | — | |
| SCHEMBL27790183 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1194001-C | Synthesis of monocrystal porphyrin | UNIV TSINGHUA (CN) | 2005-03-23 | — | — | CN | disclosed |
| CN-1403460-A | Synthesis of monocrystal porphyrin | UNIV TSINGHUA (CN) | 2003-03-19 | — | — | CN | disclosed |