⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7122407 | 0.72 | — | — | |
| SCHEMBL3139344 | 0.68 | — | — | |
| SCHEMBL30569 | 0.68 | — | — | |
| SCHEMBL9793591 | 0.67 | TSHR (0.50) | — | |
| SCHEMBL29171272 | 0.66 | FDPS (0.32) | — | |
| SCHEMBL8850158 | 0.65 | — | — | |
| SCHEMBL8850161 | 0.63 | — | — | |
| SCHEMBL7122410 | 0.63 | MPI (0.31) | — | |
| SCHEMBL1497604 | 0.62 | — | — | |
| Hypophosphorous Acid SCHEMBL7155853 | 0.61 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4202779-A | FIRE RETARDANTS FOR POLYURETHANES | THE UPJOHN COMPANY (US) | 1980-05-13 | — | — | US | disclosed |
| US-4202946-A | BIS/2-HYDROLYALKYL/-N,N-DI(LOWER ALKYL)AMINOMETHYL PHOSPHONATES | THE UPJOHN COMPANY (US) | 1980-05-13 | — | — | US | disclosed |
| US-4173602-A | PREPARAED FROM PHOSPHORUS TRICHLORIDE, A DIOL, AND PROPYLENE OXIDE | THE UPJOHN COMPANY (US) | 1979-11-06 | — | — | US | disclosed |
| US-4112014-A | FLAME RETARDANTS FOR POLYURETHANES | THE UPJOHN COMPANY (US) | 1978-09-05 | — | — | US | disclosed |