⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2153940 | 0.84 | — | — | |
| SCHEMBL265599 | 0.74 | — | — | |
| SCHEMBL5572832 | 0.74 | — | — | |
| SCHEMBL5574167 | 0.74 | — | — | |
| SCHEMBL21048239 | 0.72 | — | — | |
| SCHEMBL10584647 | 0.68 | — | — | |
| SCHEMBL14109379 | 0.66 | GAA (0.33) | — | |
| SCHEMBL10583513 | 0.63 | CA1 (0.32) | — | |
| SCHEMBL375854 | 0.63 | — | — | |
| SCHEMBL6590344 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0069811-B1 | BRANCHED AMIDES OF L-ASPARTYL-D-AMINO ACID DIPEPTIDES AND COMPOSITIONS THEREOF | PFIZER INC. (US) | 1984-10-24 | — | — | EP | disclosed |
| US-4399163-A | ARTIFICIAL SWEETENERS | PFIZER INC. (US) | 1983-08-16 | — | — | US | disclosed |