⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28481447 | 0.81 | — | — | |
| SCHEMBL17598026 | 0.77 | LDHA (0.30) | — | |
| SCHEMBL7693028 | 0.77 | — | — | |
| Biguanide SCHEMBL17701180 | 0.76 | LDHA (0.35) | — | |
| SCHEMBL4477680 | 0.72 | — | — | |
| SCHEMBL8005600 | 0.72 | TDP1 (0.36) | — | |
| SCHEMBL8712304 | 0.71 | — | — | |
| Formaldehyde SCHEMBL11059062 | 0.71 | — | — | |
| SCHEMBL7697745 | 0.70 | — | — | |
| Biguanide SCHEMBL4198353 | 0.69 | ACHE (0.40) | — |
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 |