⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26978557 | 0.89 | — | — | |
| Butane SCHEMBL5432739 | 0.74 | — | — | |
| Butane SCHEMBL5445262 | 0.68 | — | — | |
| Butane SCHEMBL3385994 | 0.68 | — | — | |
| Butane SCHEMBL863824 | 0.67 | — | — | |
| Butane SCHEMBL4873910 | 0.67 | — | — | |
| Butane SCHEMBL2191135 | 0.67 | — | — | |
| Butane SCHEMBL9133013 | 0.67 | — | — | |
| Butane SCHEMBL3383167 | 0.67 | — | — | |
| Butane SCHEMBL5143505 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5273932-A | Heating the substrate and using a laser of wavelength less than photon energy required for decomposing the gallium and indium organometallic compounds to effect a difference in growth rate | NIPPON TELEGRAPH & TELEPHONE CORP. (JP) | 1993-12-28 | — | — | US | claimed |