⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL82304 | 0.80 | — | — | |
| SCHEMBL9020435 | 0.80 | — | — | |
| Ammonia Solution, Strong SCHEMBL27508580 | 0.77 | — | — | |
| SCHEMBL31520440 | 0.77 | UHRF1 (0.41) | — | |
| SCHEMBL10021907 | 0.69 | CCR1 (0.41) | — | |
| SCHEMBL5666185 | 0.67 | UHRF1 (0.35) | — | |
| SCHEMBL426574 | 0.65 | — | — | |
| SCHEMBL755027 | 0.65 | — | — | |
| SCHEMBL6090433 | 0.65 | — | — | |
| SCHEMBL7921671 | 0.65 | — | — |
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-1363705-B9 | COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES | BRISTOL MYERS SQUIBB CO (US) | 2012-11-07 | — | — | EP | disclosed |
| EP-1363705-B1 | COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES | BRISTOL MYERS SQUIBB CO (US) | 2012-06-13 | — | — | EP | disclosed |