⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL74924 | 0.76 | — | — | |
| SCHEMBL1079690 | 0.76 | — | — | |
| SCHEMBL11238021 | 0.72 | — | — | |
| Alcohol SCHEMBL11787379 | 0.67 | ALDH1A1 (0.38) | — | |
| SCHEMBL11225558 | 0.65 | — | — | |
| SCHEMBL74925 | 0.65 | — | — | |
| Butane SCHEMBL11659738 | 0.64 | — | — | |
| SCHEMBL14285718 | 0.62 | — | — | |
| SCHEMBL11864564 | 0.62 | — | — | |
| Butane SCHEMBL6847278 | 0.62 | — | — |
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-4361696-A | COPOLYMERIZATION WITH VINYL MONOMER; PROTECTIVE COATINGS | BLOUNT DAVID H | 1982-11-30 | — | — | US | disclosed |
| US-4354019-A | MOLDING MATERIALS, ADHESIVES, COATINGS | BLOUNT DAVID H | 1982-10-12 | — | — | US | disclosed |
| US-4346180-A | POLYURETHANE FOAMS | BLOUNT DAVID H | 1982-08-24 | — | — | US | disclosed |
| US-4346192-A | POLYURETHANE-POLYSILICATE INSULATING FOAMS | BLOUNT DAVID H | 1982-08-24 | — | — | US | disclosed |
| US-4321184-A | FROM OXIDATED SILICON COMPOUNDS AND SUBSTITUTED ORGANIC COMPOUND IN PORESENCE OF AN ALKALI COMPOUND | BLOUNT DAVID H | 1982-03-23 | — | — | US | disclosed |