⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9568028 | 0.84 | — | — | |
| SCHEMBL952622 | 0.83 | — | — | |
| SCHEMBL12050684 | 0.79 | KDM4E (0.35) | — | |
| SCHEMBL9196900 | 0.78 | TDP1 (0.33) | — | |
| SCHEMBL28633894 | 0.76 | KDM6B (0.47) | — | |
| SCHEMBL1966242 | 0.76 | MAPK1 (0.31) | — | |
| SCHEMBL8491984 | 0.76 | — | — | |
| SCHEMBL4890544 | 0.74 | — | — | |
| SCHEMBL17275475 | 0.74 | NOS2 (0.53) | — | |
| SCHEMBL17275471 | 0.74 | NOS2 (0.53) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5574016-A | Peptide compound and a process for the preparation thereof | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-11-12 | — | — | US | claimed |