⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16351602 | 0.97 | POLB (0.31) | — | |
| SCHEMBL16351603 | 0.77 | POLB (0.45) | — | |
| SCHEMBL16351610 | 0.77 | POLB (0.33) | — | |
| SCHEMBL16351582 | 0.77 | POLB (0.40) | — | |
| SCHEMBL12269118 | 0.77 | — | — | |
| SCHEMBL16351611 | 0.73 | POLB (0.38) | — | |
| SCHEMBL16351618 | 0.72 | POLB (0.36) | — | |
| SCHEMBL16351624 | 0.72 | POLB (0.36) | — | |
| SCHEMBL12221572 | 0.72 | GABRR1 (0.32) | — | |
| SCHEMBL16351593 | 0.71 | POLB (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9217109-B2 | Polymer-stabilised liquid-crystal media and displays | MERCK PATENT GMBH (DE) | 2015-12-22 | — | — | US | disclosed |
| US-20130119311-A1 | POLYMER-STABILISED LIQUID-CRYSTAL MEDIA AND DISPLAYS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2013-05-16 | — | — | US | disclosed |