⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16913963 | 0.77 | — | — | |
| SCHEMBL16913966 | 0.77 | — | — | |
| SCHEMBL11578925 | 0.76 | — | — | |
| SCHEMBL11267036 | 0.76 | ALDH1A1 (0.40) | — | |
| SCHEMBL28612093 | 0.75 | — | — | |
| SCHEMBL11839111 | 0.74 | CXCR3 (0.40) | — | |
| SCHEMBL27633323 | 0.74 | CXCR3 (0.40) | — | |
| SCHEMBL28618665 | 0.74 | — | — | |
| SCHEMBL6403823 | 0.74 | — | — | |
| SCHEMBL6403826 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6794525-B2 | USING CHIRAL DIPHOSPHINES AS OPTICALLY ACTIVE LIGANDS FOR THE PREPARATION OF DIPHOSPHINO-METAL COMPLEXES | PPG-SIPSY (FR) | 2004-09-21 | — | — | US | disclosed |
| US-20030195369-A1 | Optically active chiral diphosphine ligands | PPG-SIPSY (FR) | 2003-10-16 | — | — | US | disclosed |
| EP-1305324-A1 | USE OF CHIRAL DIPHOSPHINES AS OPTICALLY ACTIVE LIGANDS | PPG-Sipsy (FR) | 2003-05-02 | — | — | EP | disclosed |
| WO-2002012253-A1 | USE OF CHIRAL DIPHOSPHINES AS OPTICALLY ACTIVE LIGANDS | PPG-SIPSY (FR) | 2002-02-14 | — | — | WO | disclosed |