⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19952986 | 0.97 | CA1 (0.32) | — | |
| SCHEMBL19953138 | 0.97 | CA1 (0.32) | — | |
| SCHEMBL19953128 | 0.97 | CA1 (0.32) | — | |
| SCHEMBL19953144 | 0.97 | CA1 (0.32) | — | |
| SCHEMBL19953034 | 0.97 | CA1 (0.32) | — | |
| SCHEMBL19952940 | 0.97 | CA1 (0.32) | — | |
| SCHEMBL19953036 | 0.97 | CA1 (0.32) | — | |
| SCHEMBL19953195 | 0.97 | CA1 (0.32) | — | |
| SCHEMBL19953190 | 0.97 | CA1 (0.32) | — | |
| SCHEMBL19953062 | 0.97 | CA1 (0.32) | — |
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 2 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 |