Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL20878357 | 0.84 | ESR1 (0.32) | CNR2 | |
| SCHEMBL22778727 | 0.84 | NPC1 (0.35) | — | |
| SCHEMBL22752323 | 0.81 | CNR2 (0.33) | CNR1CNR2 | |
| SCHEMBL18935596 | 0.80 | NUDT1 (0.37) | CNR2 | |
| SCHEMBL18744472 | 0.78 | CNR2 (0.33) | CNR1CNR2 | |
| SCHEMBL12459189 | 0.77 | LOXL2 (0.36) | — | |
| SCHEMBL22752318 | 0.76 | AOC3 (0.31) | — | |
| SCHEMBL19069003 | 0.76 | CNR2 (0.31) | CNR2 | |
| SCHEMBL19251455 | 0.74 | GRM5 (0.35) | CNR2 | |
| SCHEMBL22778745 | 0.74 | CNR2 (0.37) | CNR1CNR2 |
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-9732083-B2 | Tricyclic gyrase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2017-08-15 | — | — | US | disclosed |