⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17488385 | 0.98 | PDK2 (0.31) | — | |
| SCHEMBL17488416 | 0.91 | HRH3 (0.32) | — | |
| SCHEMBL20382344 | 0.88 | PTGER4 (0.39) | — | |
| SCHEMBL18621859 | 0.81 | BCL2 (0.42) | — | |
| SCHEMBL18621860 | 0.80 | PTGER4 (0.36) | — | |
| SCHEMBL17488390 | 0.78 | HRH3 (0.32) | — | |
| SCHEMBL18621837 | 0.77 | NPC1 (0.37) | — | |
| SCHEMBL26032092 | 0.77 | RARB (0.39) | — | |
| SCHEMBL18308720 | 0.75 | MEN1 (0.48) | — | |
| SCHEMBL14944788 | 0.74 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230183571-A1 | LIQUID-CRYSTAL MEDIUM COMPRISING POLYMERIZABLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2023-06-15 | — | — | US | disclosed |
| US-9938229-B2 | Polymerisable compounds and the use thereof in liquid-crystal displays | MERCK PATENT GMBH (DE) | 2018-04-10 | — | — | US | disclosed |
| US-20160032189-A1 | POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS | MERCK PATENT GMBH (DE) | 2016-02-04 | — | — | US | disclosed |