⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1219418 | 0.87 | ALOX15 (0.33) | — | |
| SCHEMBL11017970 | 0.77 | TSHR (0.33) | — | |
| SCHEMBL1789251 | 0.70 | — | — | |
| SCHEMBL1047043 | 0.70 | — | — | |
| SCHEMBL5167298 | 0.70 | — | — | |
| SCHEMBL212197 | 0.70 | ALOX15 (0.37) | — | |
| SCHEMBL15017599 | 0.70 | ALOX15 (0.37) | — | |
| SCHEMBL5408970 | 0.69 | — | — | |
| Ammonia Solution, Strong SCHEMBL9685208 | 0.69 | — | — | |
| SCHEMBL2119042 | 0.68 | CD81 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998042355-A1 | PHOSPHATE-BINDING POLYMERS COMBINED WITH A CALCIUM SUPPLEMENT FOR ORAL ADMINISTRATION | GELTEX PHARMACEUTICALS, INC. (US) | 1998-10-01 | — | — | WO | disclosed |