⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16731349 | 0.77 | — | — | |
| SCHEMBL13497146 | 0.77 | — | — | |
| SCHEMBL3855953 | 0.77 | — | — | |
| SCHEMBL3437221 | 0.67 | — | — | |
| SCHEMBL7148945 | 0.63 | CA2 (0.46) | — | |
| SCHEMBL8199560 | 0.63 | CA2 (0.46) | — | |
| SCHEMBL12921945 | 0.63 | FUCA1 (0.52) | — | |
| SCHEMBL22472219 | 0.63 | FUCA1 (0.52) | — | |
| SCHEMBL20844917 | 0.63 | FUCA1 (0.52) | — | |
| SCHEMBL7948561 | 0.63 | FUCA1 (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5126437-A | ALDOPHOSPHAMIDE GLYCOSIDES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICAL ACTIVE COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1992-06-30 | — | — | US | claimed |
| US-5126437-A | ALDOPHOSPHAMIDE GLYCOSIDES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICAL ACTIVE COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1992-06-30 | — | — | US | disclosed |