⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31385 | 0.78 | — | — | |
| SCHEMBL6190437 | 0.74 | — | — | |
| SCHEMBL628091 | 0.74 | — | — | |
| SCHEMBL9351180 | 0.74 | ALOX15 (0.43) | — | |
| SCHEMBL594094 | 0.72 | — | — | |
| SCHEMBL251766 | 0.72 | — | — | |
| SCHEMBL4960693 | 0.72 | — | — | |
| SCHEMBL11030650 | 0.72 | — | — | |
| SCHEMBL4254567 | 0.69 | — | — | |
| SCHEMBL6526660 | 0.67 | FAAH (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-5331398-A | — | — | None | — | — | JP | disclosed |
| JP-H05331398-A | PIGMENT COMPOSITION | TOYO INK MFG CO LTD | 1993-12-14 | — | — | JP | disclosed |