⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4414308 | 0.92 | LMNA (0.58) | — | |
| SCHEMBL11600199 | 0.83 | LMNA (0.53) | — | |
| SCHEMBL887688 | 0.83 | LMNA (0.53) | — | |
| SCHEMBL3643415 | 0.82 | — | — | |
| SCHEMBL10354597 | 0.81 | — | — | |
| SCHEMBL769946 | 0.79 | — | — | |
| SCHEMBL598016 | 0.79 | LCK (0.56) | — | |
| SCHEMBL318519 | 0.79 | — | — | |
| SCHEMBL27690106 | 0.79 | — | — | |
| SCHEMBL11692997 | 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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1144436-A1 | METHOD FOR PREPARING BICYCLIC COMPOUNDS AND USE OF SAID METHOD FOR PREPARING AN INTERLEUKIN-1(Beta) CONVERSION ENZYME (ICE) INHIBITOR | Aventis Pharma S.A. (FR) | 2001-10-17 | — | — | EP | disclosed |
| EP-1073673-A1 | NOVEL OCTAHYDRO-6,10-DIOXO-6H-PYRIDAZINO/1,2-a/ /1,2/DIAZEPIN-1-CARBOXYLIC ACID DERIVATIVES, PREPARATION METHOD AND USE FOR PREPARING THERAPEUTICALLY ACTIVE COMPOUNDS | HOECHST MARION ROUSSEL (FR) | 2001-02-07 | — | — | EP | disclosed |
| WO-2000042061-A1 | METHOD FOR PREPARING BICYCLIC COMPOUNDS AND USE OF SAID METHOD FOR PREPARING AN INTERLEUKIN-1Β CONVERSION ENZYME (ICE) INHIBITOR | AVENTIS PHARMA S.A. (FR) | 2000-07-20 | — | — | WO | disclosed |
| CN-1046524-C | Cephalosporin derivatives | HOFFMANN LA ROCHE (CH) | 1999-11-17 | — | — | CN | disclosed |
| WO-1999055724-A1 | NOVEL OCTAHYDRO-6,10-DIOXO-6H-PYRIDAZINO/1,2-a/ /1,2/DIAZEPIN-1-CARBOXYLIC ACID DERIVATIVES, PREPARATION METHOD AND USE FOR PREPARING THERAPEUTICALLY ACTIVE COMPOUNDS | HOECHST MARION ROUSSEL (FR) | 1999-11-04 | — | — | WO | disclosed |
| CN-1105365-A | Cephalosporin derivatives | HOFFMANN LA ROCHE (CH) | 1995-07-19 | — | — | CN | disclosed |
| CN-1019387-B | PROCESS FOR PREPN. OF PROPANOL DERIVATIVES | SYN TEK AB (SE) | 1992-12-09 | — | — | CN | disclosed |
| CN-86100170-A | The preparation method of propanol derivative | — | 1986-12-17 | — | — | CN | disclosed |
| US-4078073-A | N-tricyclic derivatives of azetidine | CARLO ERBA S.P.A. (IT) | 1978-03-07 | — | — | US | disclosed |