⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1913169 | 0.75 | — | — | |
| SCHEMBL10883998 | 0.73 | — | — | |
| SCHEMBL2163661 | 0.67 | — | — | |
| SCHEMBL15659879 | 0.67 | — | — | |
| SCHEMBL3408770 | 0.66 | — | — | |
| SCHEMBL14117935 | 0.63 | — | — | |
| SCHEMBL4627087 | 0.63 | — | — | |
| Acetic Acid SCHEMBL28586564 | 0.63 | FFAR3 (0.47) | — | |
| SCHEMBL3161996 | 0.63 | — | — | |
| SCHEMBL11236391 | 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-3272749-A1 | AMINO-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINECARBOXAMIDES AND THEIR USE AS STIMULATORS OF SOLUBLE GUANYLATE CYCLASE | Bayer Pharma Aktiengesellschaft (DE) | 2018-01-24 | — | — | EP | disclosed |
| EP-0019112-B1 | PROCESS FOR THE PREPARATION OF CYCLIC ACETALS OF TRANS-4-CHLORO-3-METHYL-2-BUTEN-1-AL AND PREPARATION OF TRANS-3-METHYL-2-BUTEN-1,4-DIAL-MONOACETALS | BASF Aktiengesellschaft (DE) | 1982-11-17 | — | — | EP | disclosed |
| US-4335047-A | Preparation of cyclic acetals of trans-4-chloro-3-methyl-but-2-en-1-al, and preparation of trans-3-methyl-but-2-ene-1,4-dial-1-monoacetals | BASF AKTIENGESELLSCHAFT (DE) | 1982-06-15 | — | — | US | disclosed |
| EP-0019112-A1 | Process for the preparation of cyclic acetals of trans-4-chloro-3-methyl-2-buten-1-al and preparation of trans-3-methyl-2-buten-1,4-dial-monoacetals | BASF Aktiengesellschaft (DE) | 1980-11-26 | — | — | EP | disclosed |