⚠ 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 SCHEMBL3682110 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL21110507 | 0.80 | — | — | |
| SCHEMBL28052635 | 0.79 | SQOR (0.30) | — | |
| Hydrochloric Acid SCHEMBL1072131 | 0.78 | — | — | |
| SCHEMBL20994386 | 0.78 | — | — | |
| SCHEMBL4500836 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL18420277 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL18420818 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL400986 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL2865079 | 0.77 | — | — |
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-20100069588-A1 | PROCESS FOR PRODUCTION OF SYNDIOTACTIC PROPYLENE POLYMER | Mitsuri Chemicals Inc. | 2010-03-18 | — | — | US | disclosed |