⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10763431 | 1.00 | — | — | |
| SCHEMBL6671690 | 0.80 | — | — | |
| SCHEMBL9651313 | 0.80 | — | — | |
| SCHEMBL3804219 | 0.74 | — | — | |
| SCHEMBL14950 | 0.74 | — | — | |
| SCHEMBL14952 | 0.74 | — | — | |
| SCHEMBL326917 | 0.72 | GRIK1 (0.33) | — | |
| SCHEMBL8772984 | 0.72 | GABRP (0.42) | — | |
| SCHEMBL157072 | 0.72 | GRIK1 (0.33) | — | |
| SCHEMBL8772980 | 0.72 | GABRP (0.42) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-12070734-B2 | Aerogel for harvesting atmospheric water | NATIONAL UNIVERSITY OF SINGAPORE (SG) | 2024-08-27 | — | — | US | disclosed |
| US-20220280915-A1 | AEROGEL FOR HARVESTING ATMOSPHERIC WATER | NATIONAL UNIVERSITY OF SINGAPORE (SG) | 2022-09-08 | — | — | US | disclosed |