⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL395971 | 0.81 | — | — | |
| SCHEMBL4682202 | 0.79 | — | — | |
| SCHEMBL5693242 | 0.79 | — | — | |
| SCHEMBL2382328 | 0.79 | — | — | |
| Bromide SCHEMBL31013626 | 0.76 | F2RL1 (0.36) | — | |
| SCHEMBL11127820 | 0.76 | F2RL1 (0.46) | — | |
| SCHEMBL7564563 | 0.76 | F2RL1 (0.36) | — | |
| SCHEMBL8754498 | 0.76 | F2RL1 (0.38) | — | |
| SCHEMBL11188720 | 0.75 | — | — | |
| SCHEMBL1696874 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015179441-A2 | MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS | RQX PHARMACEUTICALS, INC. (US) | 2015-11-26 | — | — | WO | disclosed |