⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL352066 | 1.00 | — | — | |
| SCHEMBL7725 | 0.79 | — | — | |
| SCHEMBL2556849 | 0.79 | — | — | |
| SCHEMBL5316239 | 0.78 | — | — | |
| SCHEMBL15405111 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL3894177 | 0.72 | — | — | |
| SCHEMBL5555 | 0.72 | — | — | |
| SCHEMBL9065633 | 0.72 | — | — | |
| SCHEMBL17222435 | 0.72 | — | — | |
| SCHEMBL5438089 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3947381-A2 | NOVEL PROCESS FOR THE PREPARATION OF FILGOTINIB AND INTERMEDIATES THEREOF | Unichem Laboratories Ltd (IN) | 2022-02-09 | — | — | EP | disclosed |
| WO-2020201975-A2 | NOVEL PROCESS FOR THE PREPARATION OF FILGOTINIB AND INTERMEDIATES THEREOF | UNICHEM LABORATORIES LIMITED (IN) | 2020-10-08 | — | — | WO | disclosed |