⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL308407 | 0.85 | TFPI2 (0.36) | — | |
| SCHEMBL1275413 | 0.83 | TFPI2 (0.38) | — | |
| SCHEMBL308951 | 0.83 | TFPI2 (0.38) | — | |
| SCHEMBL7713682 | 0.77 | — | — | |
| SCHEMBL7713678 | 0.77 | KDM4E (0.31) | — | |
| SCHEMBL28496654 | 0.76 | KDM4E (0.34) | — | |
| SCHEMBL28586943 | 0.76 | KDM4E (0.34) | — | |
| SCHEMBL15069506 | 0.72 | TFPI2 (0.39) | — | |
| SCHEMBL27992798 | 0.72 | PPM1B (0.37) | — | |
| SCHEMBL8848966 | 0.71 | KDM4E (0.31) | — |
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-6376559-B1 | SILICA SOL IN SOLVENT | BASF NOF COATINGS CO., LTD. (JP) | 2002-04-23 | — | — | US | disclosed |