⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26216223 | 0.80 | GJB2 (0.31) | — | |
| SCHEMBL20374902 | 0.78 | SMPD1 (0.34) | — | |
| SCHEMBL14418028 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL12749244 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL15760602 | 0.78 | FGF1 (0.31) | — | |
| SCHEMBL12017367 | 0.75 | OGA (0.38) | — | |
| SCHEMBL18755511 | 0.74 | — | — | |
| SCHEMBL10366417 | 0.74 | FGF1 (0.31) | — | |
| SCHEMBL23893995 | 0.73 | SSTR1 (0.37) | — | |
| SCHEMBL12899889 | 0.73 | ADORA3 (0.36) | — |
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-20160354315-A1 | DOSAGE FORMS AND USE THEREOF | Triastek, Inc. (CN) | 2016-12-08 | — | — | US | disclosed |