⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12269670 | 0.74 | — | — | |
| SCHEMBL23829740 | 0.73 | — | — | |
| SCHEMBL31084621 | 0.72 | CES2 (0.32) | — | |
| SCHEMBL25763611 | 0.72 | — | — | |
| SCHEMBL17315650 | 0.72 | — | — | |
| SCHEMBL17315648 | 0.72 | — | — | |
| SCHEMBL27677423 | 0.71 | — | — | |
| SCHEMBL12269632 | 0.70 | — | — | |
| SCHEMBL25682310 | 0.70 | — | — | |
| SCHEMBL14667543 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018048297-A1 | ORGANOSILOXANE HYBRID COMPOSITION FOR ENCAPSULATION OF LIGHT-EMITTING ELEMENTS | PENCHEM TECHNOLOGIES SDN. BHD. (MY) | 2018-03-15 | — | — | WO | claimed |
| WO-2018048297-A1 | ORGANOSILOXANE HYBRID COMPOSITION FOR ENCAPSULATION OF LIGHT-EMITTING ELEMENTS | PENCHEM TECHNOLOGIES SDN. BHD. (MY) | 2018-03-15 | — | — | WO | disclosed |
| US-20090285888-A1 | DERIVATIVES OF DIHYDROXYPHENYLALANINE | ELLNEUROXX LTD. (DE) | 2009-11-19 | — | — | US | disclosed |
| US-5266668-A | Substituted phenyl α-fluoroacrylates | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-11-30 | — | — | US | disclosed |