⚠ 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 SCHEMBL7933608 | 0.99 | — | — | |
| Hydrochloric Acid SCHEMBL7920365 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL7911382 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL7920675 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL7920305 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL7910831 | 0.77 | — | — | |
| SCHEMBL5080103 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL2936619 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL5079206 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL7923522 | 0.76 | — | — |
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-6225407-B1 | IMPACT-RESISTANT, FLEXURAL STRENGTH AND ELONGATION AT BREAK | TICONA GMBH (DE) | 2001-05-01 | — | — | US | disclosed |