⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7219725 | 0.96 | — | — | |
| SCHEMBL694028 | 0.95 | — | — | |
| SCHEMBL640515 | 0.91 | — | — | |
| SCHEMBL639785 | 0.91 | — | — | |
| SCHEMBL4311561 | 0.91 | — | — | |
| SCHEMBL14736482 | 0.91 | — | — | |
| SCHEMBL9304334 | 0.91 | — | — | |
| SCHEMBL4649250 | 0.91 | — | — | |
| SCHEMBL16612012 | 0.91 | — | — | |
| SCHEMBL1207560 | 0.91 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101360499-B | The purposes of pyrazolo [1,5-A] pyrimidine derivatives in the kinase whose medicine of preparation Profilin | MERCK SHARP & DOHME CORP. (US) | 2015-10-07 | — | — | CN | disclosed |
| US-5104841-A | Trialkylsilylamide-chromium complex on refractory support | PHILLIPS PETROLEUM COMPANY (US) | 1992-04-14 | — | — | US | disclosed |