⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3758975 | 0.79 | — | — | |
| SCHEMBL334564 | 0.79 | F2R (0.31) | — | |
| SCHEMBL20485048 | 0.74 | — | — | |
| SCHEMBL2571959 | 0.73 | — | — | |
| SCHEMBL2378666 | 0.73 | CTSK (0.31) | — | |
| SCHEMBL2379450 | 0.73 | CTSK (0.31) | — | |
| SCHEMBL28212085 | 0.73 | GNAI3 (0.31) | — | |
| SCHEMBL5901471 | 0.73 | SPR (0.33) | — | |
| SCHEMBL2721518 | 0.72 | MLYCD (0.33) | — | |
| SCHEMBL15355468 | 0.72 | — | — |
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-20180250273-A1 | SUBSTITUTED 1,2-DIHYDRO-3H-PYRROLO[1,2-c]IMIDAZOL-3-ONE ANTIBACTERIAL COMPOUNDS | IDORSIA PHARMACEUTICALS LTD. (CH) | 2018-09-06 | — | — | US | disclosed |