⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14305091 | 0.74 | — | — | |
| SCHEMBL20171405 | 0.72 | — | — | |
| SCHEMBL25098462 | 0.71 | — | — | |
| SCHEMBL14382361 | 0.71 | ALDH1A1 (0.31) | — | |
| SCHEMBL22198624 | 0.70 | — | — | |
| SCHEMBL14290767 | 0.68 | — | — | |
| SCHEMBL29326635 | 0.67 | — | — | |
| SCHEMBL24258413 | 0.67 | — | — | |
| SCHEMBL23189533 | 0.66 | — | — | |
| SCHEMBL20962181 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10294256-B2 | Phosphine oxide alkyl amide substituted heteroaryl compounds as modulators of IL-12, IL-23 and/or IFN alpha responses | BRISTOL-MYERS SQUIBB COMPANY (US) | 2019-05-21 | — | — | US | disclosed |
| US-20180162889-A1 | PHOSPHINE OXIDE ALKYL AMIDE SUBSTITUTED HETEROARYL COMPOUNDS AS MODULATORS OF IL-12, IL-23, AND/OR IFN ALPHA RESPONSES | BRISTOL-MYERS SQUIBB COMPANY | 2018-06-14 | — | — | US | disclosed |