⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15655993 | 0.87 | TBXAS1 (0.31) | — | |
| SCHEMBL4316822 | 0.84 | — | — | |
| SCHEMBL27148815 | 0.81 | — | — | |
| SCHEMBL2175550 | 0.81 | — | — | |
| SCHEMBL7936281 | 0.77 | ALOX15 (0.36) | — | |
| SCHEMBL28583316 | 0.76 | — | — | |
| SCHEMBL472783 | 0.76 | — | — | |
| SCHEMBL3682250 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL28983309 | 0.76 | ALOX15 (0.34) | — | |
| SCHEMBL21980345 | 0.74 | ALDH1A1 (0.46) | — |
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-20140120242-A1 | ADHESION PROMOTER | ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) | 2014-05-01 | — | — | US | disclosed |