⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL730124 | 0.84 | — | — | |
| SCHEMBL3681797 | 0.78 | — | — | |
| SCHEMBL12978420 | 0.76 | — | — | |
| SCHEMBL12872732 | 0.76 | — | — | |
| SCHEMBL12847922 | 0.76 | — | — | |
| SCHEMBL12872733 | 0.76 | — | — | |
| SCHEMBL17375998 | 0.76 | — | — | |
| SCHEMBL11021300 | 0.70 | — | — | |
| SCHEMBL9254193 | 0.70 | — | — | |
| SCHEMBL10938030 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-59025812-A | — | — | None | — | — | JP | disclosed |
| EP-2271693-A1 | METHOD FOR BRIGHTENING POLYISOCYANATES USING OZONE-CONTAINING GAS | BASF SE (DE) | 2011-01-12 | — | — | EP | disclosed |
| WO-2009121881-A1 | METHOD FOR BRIGHTENING POLYISOCYANATES USING OZONE-CONTAINING GAS | BASF SE (DE) | 2009-10-08 | — | — | WO | disclosed |
| WO-1990013609-A1 | NOVEL FLUORESCENT PIGMENT COMPOSITIONS AND A PROCESS FOR THEIR PREPARATION AND USE OF SAME | MALLAVARAPU LEO X (US) | 1990-11-15 | — | — | WO | disclosed |
| JP-S5925812-A | PREPARATION OF URETHANE PREPOLYMER COMPOSITION | TAKEDA CHEM IND LTD | 1984-02-09 | — | — | JP | disclosed |