⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6232509 | 0.92 | — | — | |
| SCHEMBL6240824 | 0.78 | — | — | |
| SCHEMBL3941697 | 0.73 | — | — | |
| SCHEMBL3965482 | 0.72 | — | — | |
| SCHEMBL83693 | 0.69 | — | — | |
| SCHEMBL84155 | 0.69 | — | — | |
| SCHEMBL6626250 | 0.69 | — | — | |
| SCHEMBL9421489 | 0.66 | TSHR (0.35) | — | |
| SCHEMBL9668013 | 0.66 | TSHR (0.35) | — | |
| SCHEMBL9670647 | 0.66 | TSHR (0.35) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1532210-A1 | RYLENE DYES | BASF AKTIENGESELLSCHAFT (DE) | 2005-05-25 | — | — | EP | disclosed |
| WO-2004026965-A1 | RYLENE DYES | BASF AKTIENGESELLSCHAFT (DE) | 2004-04-01 | — | — | WO | disclosed |
| EP-0869959-A1 | 1,7-DISUBSTITUTED PERYLENE-3,4,9,10-TETRACARBOXYLIC ACIDS AND DIANHYDRIDES AND DIIMIDES OF SAID ACIDS | BASF AKTIENGESELLSCHAFT (DE) | 1998-10-14 | — | — | EP | disclosed |
| WO-1997022608-A1 | 1,7-DISUBSTITUTED PERYLENE-3,4,9,10-TETRACARBOXYLIC ACIDS AND DIANHYDRIDES AND DIIMIDES OF SAID ACIDS | BASF AKTIENGESELLSCHAFT (DE) | 1997-06-26 | — | — | WO | disclosed |