⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1114270 | 1.00 | — | — | |
| SCHEMBL1114268 | 1.00 | — | — | |
| SCHEMBL1114728 | 0.86 | CA1 (0.32) | — | |
| SCHEMBL1114724 | 0.86 | CA1 (0.32) | — | |
| SCHEMBL1114726 | 0.86 | CA1 (0.32) | — | |
| SCHEMBL2499551 | 0.78 | PDF (0.30) | — | |
| SCHEMBL837055 | 0.74 | — | — | |
| SCHEMBL14908802 | 0.72 | DPP4 (0.33) | — | |
| SCHEMBL28608405 | 0.70 | CA2 (0.31) | — | |
| SCHEMBL20480142 | 0.69 | CA1 (0.35) | — |
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-8148546-B2 | Tetrahydrocarbazole derivatives as ligands of G-protein coupled receptors | AETERNA ZENTARIS GMBH (DE) | 2012-04-03 | — | — | US | disclosed |
| US-8067456-B2 | Tetrahydrocarbazole derivatives having improved biological action and improved solubility as ligands of G-protein coupled receptors (GPCPs) | AETERNA ZENTARIS GMBH (DE) | 2011-11-29 | — | — | US | disclosed |