⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL733773 | 0.77 | — | — | |
| SCHEMBL869807 | 0.73 | CHRM2 (0.33) | — | |
| SCHEMBL8756302 | 0.71 | — | — | |
| SCHEMBL1026751 | 0.69 | — | — | |
| SCHEMBL21037771 | 0.64 | — | — | |
| SCHEMBL3073249 | 0.62 | — | — | |
| SCHEMBL12918801 | 0.62 | — | — | |
| SCHEMBL4417836 | 0.60 | TSHR (0.33) | — | |
| SCHEMBL16743104 | 0.59 | — | — | |
| SCHEMBL1859839 | 0.58 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0464058-B1 | FERROELECTRIC LIQUID CRYSTAL MIXTURES | HOECHST AG (DE) | 1995-06-14 | — | — | EP | claimed |
| US-5378394-A | Pyrimidine compounds | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-01-03 | — | — | US | claimed |
| EP-0464058-A1 | FERROELECTRIC LIQUID CRYSTAL MIXTURES. | HOECHST AG (DE) | 1992-01-08 | — | — | EP | claimed |
| EP-0412409-A2 | Liquid crystal mixtures, especially ferroelectric liquid crystal mixtures and their use in electrooptic devices | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-02-13 | — | — | EP | claimed |
| WO-1990011335-A1 | FERROELECTRIC LIQUID CRYSTAL MIXTURES | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-10-04 | — | — | WO | claimed |
| EP-0464058-B1 | FERROELECTRIC LIQUID CRYSTAL MIXTURES | HOECHST AG (DE) | 1995-06-14 | — | — | EP | disclosed |
| US-5378394-A | Pyrimidine compounds | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-01-03 | — | — | US | disclosed |
| US-5378394-A | Pyrimidine compounds | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-01-03 | — | — | US | disclosed |
| EP-0464058-A1 | FERROELECTRIC LIQUID CRYSTAL MIXTURES. | HOECHST AG (DE) | 1992-01-08 | — | — | EP | disclosed |
| EP-0412409-A2 | Liquid crystal mixtures, especially ferroelectric liquid crystal mixtures and their use in electrooptic devices | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-02-13 | — | — | EP | disclosed |
| WO-1990011335-A1 | FERROELECTRIC LIQUID CRYSTAL MIXTURES | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-10-04 | — | — | WO | disclosed |
| WO-1990011335-A1 | FERROELECTRIC LIQUID CRYSTAL MIXTURES | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-10-04 | — | — | WO | disclosed |