⚠ 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 | |
|---|---|---|---|---|
| Phosphine SCHEMBL7553985 | 1.00 | — | — | |
| SCHEMBL26908 | 0.95 | — | — | |
| SCHEMBL10948468 | 0.95 | — | — | |
| SCHEMBL10749779 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL8653125 | 0.90 | TSHR (0.36) | — | |
| Bromide SCHEMBL592841 | 0.90 | — | — | |
| Fluoride SCHEMBL1260466 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL8653131 | 0.90 | — | — | |
| SCHEMBL11772865 | 0.90 | — | — | |
| Water SCHEMBL675388 | 0.90 | — | — |
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-5116888-A | Addition-condensation copolymer | THE GLIDDEN COMPANY (US) | 1992-05-26 | — | — | US | disclosed |