⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL298177 | 0.85 | ALOX5 (0.32) | — | |
| SCHEMBL30758867 | 0.82 | CA2 (0.35) | — | |
| SCHEMBL30758866 | 0.82 | CA2 (0.35) | — | |
| SCHEMBL7907472 | 0.73 | CA2 (0.36) | — | |
| SCHEMBL20558662 | 0.71 | CA2 (0.35) | — | |
| SCHEMBL2741240 | 0.71 | CA2 (0.35) | — | |
| SCHEMBL397768 | 0.69 | ALOX5 (0.36) | — | |
| SCHEMBL3132042 | 0.69 | LDHA (0.35) | — | |
| SCHEMBL10412814 | 0.69 | ESR1 (0.48) | — | |
| SCHEMBL20110961 | 0.68 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7488572-B2 | Image formation method | FUJIFILM CORPORATION (JP) | 2009-02-10 | — | — | US | disclosed |