⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11483159 | 0.71 | — | — | |
| SCHEMBL29220636 | 0.71 | — | — | |
| SCHEMBL10999750 | 0.69 | — | — | |
| SCHEMBL4428965 | 0.68 | — | — | |
| SCHEMBL15656317 | 0.67 | — | — | |
| SCHEMBL11490729 | 0.67 | — | — | |
| SCHEMBL2859010 | 0.67 | ALDH1A1 (0.39) | — | |
| SCHEMBL15496664 | 0.67 | — | — | |
| SCHEMBL15658264 | 0.65 | — | — | |
| SCHEMBL11874373 | 0.65 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0284702-B1 | SUBSTITUTED CYCLOBUTANONE AND PROCESS FOR ITS PREPARATION | CIBA-GEIGY AG (CH) | 1989-11-08 | — | — | EP | claimed |
| EP-0284702-A1 | Substituted cyclobutanone and process for its preparation | CIBA-GEIGY AG (CH) | 1988-10-05 | — | — | EP | claimed |
| EP-0284702-B1 | SUBSTITUTED CYCLOBUTANONE AND PROCESS FOR ITS PREPARATION | CIBA-GEIGY AG (CH) | 1989-11-08 | — | — | EP | disclosed |
| EP-0284702-A1 | Substituted cyclobutanone and process for its preparation | CIBA-GEIGY AG (CH) | 1988-10-05 | — | — | EP | disclosed |
| EP-0004316-B1 | ESTERS OF CYCLOPROPANE CARBOXYLIC ACID, METHOD OF PREPARATION AND USE IN PARASITE CONTROL | CIBA-GEIGY AG (CH) | 1981-09-23 | — | — | EP | disclosed |
| EP-0004316-A2 | Esters of cyclopropane carboxylic acid, method of preparation and use in parasite control | CIBA-GEIGY AG (CH) | 1979-10-03 | — | — | EP | disclosed |