⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16241085 | 0.80 | CACNA1H (0.43) | — | |
| SCHEMBL15049935 | 0.79 | NCF1 (0.32) | — | |
| SCHEMBL1516424 | 0.74 | — | — | |
| SCHEMBL23379171 | 0.72 | GBA1 (0.37) | — | |
| SCHEMBL708613 | 0.72 | GNAI3 (0.33) | — | |
| SCHEMBL15967368 | 0.72 | CACNA1H (0.35) | — | |
| SCHEMBL15967264 | 0.72 | — | — | |
| SCHEMBL18170297 | 0.70 | PDK1 (0.34) | — | |
| SCHEMBL1515289 | 0.70 | — | — | |
| SCHEMBL1515287 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1869019-B1 | BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS | PFIZER PROD INC (US) | 2014-08-27 | — | — | EP | claimed |