⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL34433747 | 0.69 | CES2 (0.30) | — | |
| SCHEMBL13589753 | 0.69 | — | — | |
| SCHEMBL19498995 | 0.68 | ABAT (0.32) | — | |
| SCHEMBL27296930 | 0.67 | TSHR (0.30) | — | |
| SCHEMBL28442817 | 0.64 | — | — | |
| SCHEMBL6765173 | 0.61 | MAOA (0.32) | — | |
| SCHEMBL325503 | 0.60 | — | — | |
| SCHEMBL10328477 | 0.60 | — | — | |
| SCHEMBL1353356 | 0.58 | TSHR (0.42) | — | |
| SCHEMBL13140760 | 0.58 | TSHR (0.39) | — |
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-20090306169-A1 | Use of Fused Pyrrole Carboxylic Acids for the Treatment of Neurodegenerative and Psychiatric Diseases and D-Amino Acid Oxidase Inhibitors | BRANDISH PHILIP E | 2009-12-10 | — | — | US | disclosed |