⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL16540232 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL6820706 | 0.78 | — | — | |
| SCHEMBL23355198 | 0.76 | — | — | |
| SCHEMBL7265525 | 0.71 | — | — | |
| SCHEMBL906547 | 0.70 | — | — | |
| SCHEMBL10617463 | 0.69 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL10619688 | 0.69 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL11013507 | 0.67 | — | — | |
| SCHEMBL4912201 | 0.66 | — | — | |
| SCHEMBL9472199 | 0.65 | — | — |
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-20040126778-A1 | Isolation of dna molecules | CYTIVA BIOPROCESS R&D AB (SE) | 2004-07-01 | — | — | US | claimed |