⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16154142 | 0.82 | — | — | |
| SCHEMBL9386386 | 0.76 | — | — | |
| SCHEMBL25785329 | 0.76 | — | — | |
| SCHEMBL4597261 | 0.76 | — | — | |
| SCHEMBL771475 | 0.71 | — | — | |
| SCHEMBL14952311 | 0.71 | DPP7 (0.40) | — | |
| SCHEMBL28353718 | 0.70 | DPP7 (0.46) | — | |
| SCHEMBL17356982 | 0.69 | DPP7 (0.35) | — | |
| SCHEMBL1468528 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL17668285 | 0.67 | DPP7 (0.34) | — |
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-9586914-B2 | Modulators of C3a receptors | THE UNIVERSITY OF QUEENSLAND (AU) | 2017-03-07 | — | — | US | disclosed |
| US-20140302069-A1 | MODULATORS OF C3A RECEPTORS | THE UNIVERSITY OF QUEENSLAND (AU) | 2014-10-09 | — | — | US | disclosed |