⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18917212 | 1.00 | PTPN1 (0.37) | — | |
| SCHEMBL10719662 | 1.00 | PTPN1 (0.37) | — | |
| SCHEMBL35657 | 1.00 | — | — | |
| SCHEMBL11798503 | 1.00 | PTPN1 (0.37) | — | |
| SCHEMBL717288 | 1.00 | — | — | |
| SCHEMBL4577627 | 1.00 | PTPN1 (0.37) | — | |
| SCHEMBL4579977 | 1.00 | PTPN1 (0.37) | — | |
| SCHEMBL7556778 | 1.00 | PTPN1 (0.37) | — | |
| SCHEMBL2422886 | 1.00 | PTPN1 (0.37) | — | |
| SCHEMBL10719666 | 1.00 | PTPN1 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017106253-A1 | CONFORMATIONALLY STRAINED TRANS-CYCLOALKENES FOR RADIOLABELING | FOX JOSEPH (US) | 2017-06-22 | — | — | WO | disclosed |
| CN-1512974-A | Selective ring-opening cross-metathesis of cycloulefins | 加利福尼亚技术学院 | 2004-07-14 | — | — | CN | disclosed |