⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29788230 | 0.66 | ALDH1A1 (0.37) | — | |
| SCHEMBL9801060 | 0.66 | SOS1 (0.34) | — | |
| Hydrochloric Acid SCHEMBL20660386 | 0.64 | SOS1 (0.33) | — | |
| SCHEMBL5832060 | 0.63 | SOS1 (0.32) | — | |
| SCHEMBL9801465 | 0.60 | TSHR (0.36) | — | |
| SCHEMBL8681623 | 0.60 | GAA (0.35) | — | |
| SCHEMBL14012741 | 0.60 | POLB (0.38) | — | |
| SCHEMBL9801146 | 0.59 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL3873641 | 0.59 | — | — | |
| SCHEMBL8380075 | 0.58 | TSHR (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-6610782-B1 | Masonry; hydrolyzable silane, a low molecular weight silicone, an amino-functional silicone, an amino-functional silane combined with a nonionic emulsifier, and the balance is water | LINDLEY LABORATORIES, INC. | 2003-08-26 | — | — | US | disclosed |