⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2742204 | 0.95 | TSHR (0.32) | — | |
| SCHEMBL10233184 | 0.93 | — | — | |
| SCHEMBL10204308 | 0.82 | — | — | |
| SCHEMBL10182743 | 0.79 | CNR1 (0.32) | — | |
| SCHEMBL18499585 | 0.77 | SCARB1 (0.32) | — | |
| SCHEMBL15450700 | 0.77 | NR4A1 (0.36) | — | |
| SCHEMBL16638144 | 0.77 | TSHR (0.34) | — | |
| SCHEMBL2742215 | 0.76 | SLC2A1 (0.32) | — | |
| SCHEMBL9963685 | 0.75 | STS (0.44) | — | |
| SCHEMBL15450682 | 0.70 | CDC25B (0.40) | — |
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-9568824-B2 | Actinic-ray- or radiation-sensitive resin composition, resist film therefrom and method of forming pattern therewith | FUJIFILM CORPORATION (JP) | 2017-02-14 | — | — | US | disclosed |