⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9521100 | 0.81 | MAPT (0.32) | — | |
| SCHEMBL8432137 | 0.73 | — | — | |
| SCHEMBL9519236 | 0.59 | — | — | |
| SCHEMBL9523406 | 0.59 | TSHR (0.44) | — | |
| Hydrochloric Acid SCHEMBL7277644 | 0.55 | KDM4E (0.36) | — | |
| SCHEMBL9321576 | 0.54 | KDM4E (0.40) | — | |
| SCHEMBL9519745 | 0.53 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL7287070 | 0.52 | CA2 (0.31) | — | |
| SCHEMBL12495467 | 0.50 | KDM4E (0.43) | — | |
| SCHEMBL20811092 | 0.49 | KDM4E (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0298196-B1 | IMIDAZOLE COMPOUNDS AND BIOCIDAL COMPOSITIONS COMPRISING THE SAME | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1993-06-02 | — | — | EP | disclosed |
| US-4995898-A | Imidazole compounds and biocidal composition comprising the same for controlling harmful organisms | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1991-02-26 | — | — | US | disclosed |
| EP-0298196-A1 | Imidazole compounds and biocidal compositions comprising the same | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1989-01-11 | — | — | EP | disclosed |