⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11237702 | 0.92 | — | — | |
| SCHEMBL17956894 | 0.89 | LMNA (0.43) | — | |
| SCHEMBL11230053 | 0.89 | LMNA (0.43) | — | |
| SCHEMBL17956865 | 0.89 | LMNA (0.43) | — | |
| SCHEMBL454438 | 0.89 | LMNA (0.43) | — | |
| SCHEMBL456201 | 0.89 | LMNA (0.43) | — | |
| SCHEMBL126795 | 0.81 | — | — | |
| SCHEMBL6437328 | 0.80 | — | — | |
| SCHEMBL7329045 | 0.78 | — | — | |
| SCHEMBL2510797 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023134439-A1 | METHOD FOR PREPARING TERTIARY AMINE BY USING SECONDARY AMINE AS RAW MATERIAL | 浙江新化化工股份有限公司 | 2023-07-20 | — | — | WO | disclosed |
| EP-3050919-A1 | MIXTURES CONTAINING LIGNOCELLULOSIC MATERIALS WITH SALTS OF N-SUBSTITUTED CARBAMIC ACIDS | BASF SE (DE) | 2016-08-03 | — | — | EP | disclosed |
| US-6833481-B2 | Catalytic dehydrative isomerization | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2004-12-21 | — | — | US | disclosed |
| US-20030109755-A1 | Process for producing 2-alkyl-2cyclopentenones | TAKASAGO INTERNATIONAL CORPORATION | 2003-06-12 | — | — | US | disclosed |
| EP-1316541-A1 | Process for producing 2-alkyl-2-cyclopentenones | Takasago International Corporation (JP) | 2003-06-04 | — | — | EP | disclosed |
| US-4351962-A | Process for the preparation of hydroxy benzene carboxaldehydes | RHONE POULENC INC. (US) | 1982-09-28 | — | — | US | disclosed |