⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9860318 | 1.00 | — | — | |
| SCHEMBL2187753 | 0.97 | — | — | |
| SCHEMBL2187750 | 0.97 | — | — | |
| SCHEMBL10308367 | 0.83 | GABRP (0.35) | — | |
| SCHEMBL10308366 | 0.83 | GABRP (0.35) | — | |
| SCHEMBL410195 | 0.75 | — | — | |
| SCHEMBL4474378 | 0.75 | — | — | |
| SCHEMBL9511867 | 0.75 | — | — | |
| SCHEMBL11171608 | 0.75 | TP53 (0.30) | — | |
| SCHEMBL27531077 | 0.73 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119662701-A | Application of transcription factor MaERF12 in regulating and controlling banana fruit aroma release | 华南农业大学 | 2025-03-21 | — | — | CN | disclosed |
| EP-0173190-B1 | PROCESS FOR THE PREPARATION OF 5-ACYL PYRIMIDINES | BAYER AG (DE) | 1991-09-11 | — | — | EP | disclosed |
| US-4806644-A | HERBICIDES, FUNGICIDES, PLANT GROWTH REGULATORS AND INTERMEDIATES | BAYER AKTIENGESELLSCHAFT (DE) | 1989-02-21 | — | — | US | disclosed |
| US-4713456-A | HERBICIDE INTERMEDIATES | BAYER AKTIENGESELLSCHAFT (DE) | 1987-12-15 | — | — | US | disclosed |
| EP-0173190-A2 | Process for the preparation of 5-acyl pyrimidines | BAYER AG (DE) | 1986-03-05 | — | — | EP | disclosed |