⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9776493 | 0.68 | TSHR (0.33) | — | |
| SCHEMBL20590932 | 0.63 | TSHR (0.30) | — | |
| SCHEMBL11542853 | 0.62 | TAAR1 (0.54) | — | |
| SCHEMBL9162557 | 0.62 | HTR2A (0.44) | — | |
| SCHEMBL31214015 | 0.56 | — | — | |
| SCHEMBL28538164 | 0.54 | — | — | |
| SCHEMBL9155660 | 0.54 | HTR2A (0.41) | — | |
| SCHEMBL27843932 | 0.53 | CYP19A1 (0.47) | — | |
| Pyrrole SCHEMBL29042136 | 0.52 | — | — | |
| SCHEMBL28544581 | 0.52 | NPC1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113448166-A | Curable resin composition, dry film, cured product, and electronic component | 太阳油墨制造株式会社 | 2021-09-28 | — | — | CN | disclosed |