⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL260008 | 0.86 | MAPT (0.41) | — | |
| SCHEMBL7593218 | 0.74 | — | — | |
| SCHEMBL895166 | 0.74 | — | — | |
| Methacrylic Acid SCHEMBL7270271 | 0.72 | MAPT (0.33) | — | |
| SCHEMBL11780768 | 0.70 | FAAH (0.36) | — | |
| SCHEMBL11645094 | 0.67 | — | — | |
| SCHEMBL24530802 | 0.65 | CRBN (0.40) | — | |
| SCHEMBL13678434 | 0.65 | CRBN (0.40) | — | |
| SCHEMBL895048 | 0.65 | — | — | |
| SCHEMBL3468436 | 0.65 | MAPT (0.32) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3966835-A | POLYALKYLENE OXIDES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-06-29 | — | — | US | claimed |
| US-4338172-A | STORAGE STABILITY OF BENZOIN ETHER CURING INITIATOR | STAUFFER CHEMICAL COMPANY (US) | 1982-07-06 | — | — | US | disclosed |
| US-4260465-A | Photopolymerizable composition stabilized with epoxide compounds and process | STAUFFER CHEMICAL COMPANY (US) | 1981-04-07 | — | — | US | disclosed |
| US-4146453-A | GELATION INHIBITION | STAUFFER CHEMICAL COMPANY (US) | 1979-03-27 | — | — | US | disclosed |
| US-3966835-A | POLYALKYLENE OXIDES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-06-29 | — | — | US | disclosed |