⚠ 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 | |
|---|---|---|---|---|
| Guanidine SCHEMBL5522467 | 0.83 | KDM4E (0.35) | — | |
| SCHEMBL27822246 | 0.76 | CA5A (0.33) | — | |
| SCHEMBL9007175 | 0.73 | — | — | |
| SCHEMBL28867559 | 0.71 | — | — | |
| SCHEMBL1263886 | 0.71 | — | — | |
| Ammonia Solution, Strong SCHEMBL28237833 | 0.71 | — | — | |
| SCHEMBL8981447 | 0.69 | PTGS1 (0.33) | — | |
| Sulfuric Acid SCHEMBL5787799 | 0.69 | ALDH1A1 (0.36) | — | |
| SCHEMBL5897059 | 0.69 | — | — | |
| Sulfuric Acid SCHEMBL8718737 | 0.69 | ALDH1A1 (0.36) | — |
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-20090042719-A1 | Hairy polymeric nanoparticles | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 2009-02-12 | — | — | US | disclosed |