⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL88697 | 0.87 | — | — | |
| SCHEMBL4274081 | 0.85 | — | — | |
| Carbimide SCHEMBL27864189 | 0.63 | — | — | |
| SCHEMBL27731141 | 0.62 | — | — | |
| SCHEMBL27867292 | 0.60 | — | — | |
| SCHEMBL36587 | 0.60 | — | — | |
| Morpholine SCHEMBL28152273 | 0.58 | — | — | |
| Hydrochloric Acid SCHEMBL3123470 | 0.58 | — | — | |
| Isothiocyanate SCHEMBL7213046 | 0.58 | — | — | |
| Piperazine SCHEMBL28841590 | 0.57 | — | — |
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-2010140902-A1 | INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR | HAMPTON MARK (NZ) | 2010-12-09 | — | — | WO | disclosed |