⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17099002 | 1.00 | — | — | |
| SCHEMBL17097667 | 0.96 | HSD11B1 (0.31) | — | |
| SCHEMBL17097664 | 0.96 | HSD11B1 (0.31) | — | |
| SCHEMBL17098502 | 0.94 | NR3C1 (0.31) | — | |
| SCHEMBL17098504 | 0.94 | NR3C1 (0.31) | — | |
| SCHEMBL17098210 | 0.94 | CETP (0.30) | — | |
| SCHEMBL17098206 | 0.94 | CETP (0.30) | — | |
| SCHEMBL17098164 | 0.93 | MEN1 (0.31) | — | |
| SCHEMBL17099230 | 0.93 | HSD11B1 (0.31) | — | |
| SCHEMBL17098165 | 0.93 | MEN1 (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9365522-B2 | Pyrazole amide derivative | AMGEN INC. (US) | 2016-06-14 | — | — | US | claimed |
| US-20150266824-A1 | Pyrazole Amide Derivative | TEIJIN LIMITED (JP) | 2015-09-24 | — | — | US | claimed |
| EP-3110810-B1 | PYRAZOLE AMIDE DERIVATIVE | TEIJIN PHARMA LTD (JP) | 2018-05-02 | — | — | EP | disclosed |