⚠ 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 | |
|---|---|---|---|---|
| Dibromomethane SCHEMBL20033 | 0.89 | — | — | |
| Dibromomethane SCHEMBL28574935 | 0.80 | — | — | |
| Dibromomethane SCHEMBL9402941 | 0.80 | — | — | |
| Dibromomethane SCHEMBL8346487 | 0.80 | — | — | |
| Dibromomethane SCHEMBL8715368 | 0.73 | — | — | |
| Dibromomethane SCHEMBL29239930 | 0.68 | — | — | |
| Dibromomethane SCHEMBL1764493 | 0.68 | — | — | |
| SCHEMBL19712792 | 0.68 | — | — | |
| Dibromomethane SCHEMBL5493647 | 0.68 | — | — | |
| Dibromomethane SCHEMBL1798285 | 0.63 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0653415-B1 | (Aryl-[1'-(aryl)-alkyl]-methylidene)- or (aryl-[1'(aryl)alkyl]-methyl)-dicarboxylic acid alkyl ester or their thiocarboxylic acid esters, process for their preparation and their use | THIEMANN ARZNEIMITTEL GMBH (DE) | 1998-06-24 | — | — | EP | disclosed |
| EP-0653415-A1 | Aryl-1'-(aryl)-alkyl-methylidene- or aryl-1'(aryl)alkyl-methyl-dicarboxylic acid alkyl ester or their thiocarboxylic acid esters, process for their preparation and their use | Thiemann Arzneimittel GmbH (DE) | 1995-05-17 | — | — | EP | disclosed |
| US-4391827-A | 3-(2-Hydroxy-4-(substituted)phenyl)-cycloalkanone and cycloalkanol analgesic agents and intermediates therefor | PFIZER INC. (US) | 1983-07-05 | — | — | US | disclosed |
| US-4306097-A | 3-[2-Hydroxy-4-(substituted)phenyl]-cycloalkanol analgesic agents | PFIZER INC. (US) | 1981-12-15 | — | — | US | disclosed |