⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20377908 | 0.87 | — | — | |
| SCHEMBL20680198 | 0.82 | THRB (0.35) | — | |
| SCHEMBL5582102 | 0.80 | CES2 (0.35) | — | |
| SCHEMBL6260350 | 0.76 | CES2 (0.32) | — | |
| SCHEMBL17926744 | 0.75 | ODC1 (0.31) | — | |
| SCHEMBL5075464 | 0.74 | THRB (0.31) | — | |
| SCHEMBL9270712 | 0.71 | CES2 (0.44) | — | |
| SCHEMBL1813630 | 0.69 | THRB (0.38) | — | |
| SCHEMBL28228317 | 0.68 | THRB (0.33) | — | |
| SCHEMBL20377902 | 0.67 | — | — |
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-8106206-B2 | Solid luminescent quinoline compounds | KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) | 2012-01-31 | — | — | US | disclosed |
| US-20110263861-A1 | QUINOLINE COMPOUND | KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) | 2011-10-27 | — | — | US | disclosed |