⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25546918 | 0.79 | — | — | |
| SCHEMBL19204323 | 0.72 | — | — | |
| SCHEMBL22440 | 0.70 | — | — | |
| SCHEMBL18758236 | 0.69 | — | — | |
| SCHEMBL20758926 | 0.69 | — | — | |
| SCHEMBL14196794 | 0.69 | — | — | |
| Dimethylamine SCHEMBL28085264 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL3526529 | 0.67 | — | — | |
| SCHEMBL14598244 | 0.67 | — | — | |
| SCHEMBL24942390 | 0.65 | — | — |
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 |