⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16707486 | 0.75 | HTR2A (0.32) | — | |
| SCHEMBL13725002 | 0.73 | HTR2A (0.31) | — | |
| SCHEMBL16707490 | 0.73 | HTR2A (0.31) | — | |
| SCHEMBL13725004 | 0.67 | KDM4E (0.36) | — | |
| SCHEMBL1004982 | 0.67 | CYP3A4 (0.32) | — | |
| SCHEMBL26073851 | 0.67 | — | — | |
| SCHEMBL16707488 | 0.65 | HTR2A (0.35) | — | |
| Ammonia Solution, Strong SCHEMBL11522629 | 0.64 | CYP3A4 (0.30) | — | |
| SCHEMBL1004507 | 0.64 | MEN1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL11505824 | 0.64 | ALDH1A1 (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5380865-A | Halogen substituents | MAY & BAKER LIMITED (GB) | 1995-01-10 | — | — | US | disclosed |
| US-5206257-A | Controlling plant nematodes, helminth, protozoa | MAY & BAKER LIMITED (GB) | 1993-04-27 | — | — | US | disclosed |
| EP-0283173-A1 | Pesticidal method using 2-phenylimidazole derivatives | RHONE-POULENC AGRICULTURE LIMITED (GB) | 1988-09-21 | — | — | EP | disclosed |