⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3132700 | 0.80 | KDM4E (0.41) | — | |
| SCHEMBL17877073 | 0.80 | KDM4E (0.41) | — | |
| SCHEMBL7466103 | 0.79 | KDM4E (0.34) | — | |
| SCHEMBL6669972 | 0.78 | — | — | |
| SCHEMBL8587571 | 0.76 | — | — | |
| SCHEMBL8856019 | 0.76 | KDM4E (0.38) | — | |
| SCHEMBL10875897 | 0.76 | — | — | |
| SCHEMBL14356161 | 0.76 | — | — | |
| SCHEMBL9066008 | 0.74 | KDM4E (0.37) | — | |
| SCHEMBL9065677 | 0.74 | KDM4E (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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-55015450-A | — | — | None | — | — | JP | disclosed |
| WO-2009067233-A1 | BETA CARBOLINES AND USES THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2009-05-28 | — | — | WO | disclosed |
| WO-2009067233-A1 | BETA CARBOLINES AND USES THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2009-05-28 | — | — | WO | disclosed |
| US-7301041-B2 | Bi-functional metallocenes, preparation process and use in the labeling or biological molecules | BIO MERIEUX (FR) | 2007-11-27 | — | — | US | disclosed |
| JP-S5515450-A | DIPHENYL ETHER DERIVATIVE AND HERBICIDE CONTAINING THE SAME | MITSUI TOATSU CHEM INC | 1980-02-02 | — | — | JP | disclosed |