⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9300555 | 0.88 | — | — | |
| SCHEMBL10411235 | 0.81 | — | — | |
| SCHEMBL7083308 | 0.76 | — | — | |
| SCHEMBL28601329 | 0.76 | CHRM5 (0.35) | — | |
| SCHEMBL11312346 | 0.76 | — | — | |
| SCHEMBL23567355 | 0.75 | KDM4E (0.31) | — | |
| SCHEMBL9305185 | 0.74 | — | — | |
| SCHEMBL7650352 | 0.74 | — | — | |
| SCHEMBL1582044 | 0.74 | — | — | |
| SCHEMBL134919 | 0.74 | TSHR (0.39) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114341223-A | Flexible polyurethane foam, preparation method and application thereof | 巴斯夫欧洲公司 | 2022-04-12 | — | — | CN | disclosed |
| US-5281486-A | Roofing material containing non-leachable fire retardant comprising an alkaline condensation product of a fusible phenolic resin and a dialkyl-n,n-bis(hydroxyalkyl) aminoalkyl phosphonate | MASONITE CORPORATION (US) | 1994-01-25 | — | — | US | disclosed |
| US-5143989-A | Condensation product of a phenolic resin and a dialkyl-N,N-bis(hydroxyalkyl)aminoalkyl phosphonate | MASONITE CORPORATION (US) | 1992-09-01 | — | — | US | disclosed |