⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20471489 | 0.71 | DHODH (0.33) | — | |
| SCHEMBL16200278 | 0.69 | HCAR2 (0.32) | — | |
| SCHEMBL13683166 | 0.67 | — | — | |
| SCHEMBL2874012 | 0.67 | P2RX7 (0.30) | — | |
| SCHEMBL6886836 | 0.62 | DHODH (0.32) | — | |
| SCHEMBL20471491 | 0.61 | HCAR2 (0.36) | — | |
| SCHEMBL1864417 | 0.57 | HCAR2 (0.35) | — | |
| SCHEMBL20471482 | 0.57 | DHODH (0.49) | — | |
| SCHEMBL8185143 | 0.56 | NR2F2 (0.32) | — | |
| SCHEMBL9261784 | 0.56 | NR2F2 (0.38) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070260059-A1 | Filters for Electronic Display Devices | KYOWA HAKKO CHEMICAL CO., LTD. (JP) | 2007-11-08 | — | — | US | disclosed |