⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21897001 | 0.69 | — | — | |
| SCHEMBL24343246 | 0.69 | — | — | |
| SCHEMBL17833111 | 0.68 | — | — | |
| SCHEMBL8000608 | 0.68 | — | — | |
| SCHEMBL27376179 | 0.68 | — | — | |
| SCHEMBL24405589 | 0.68 | — | — | |
| SCHEMBL14802281 | 0.68 | — | — | |
| SCHEMBL15109619 | 0.65 | — | — | |
| SCHEMBL19934610 | 0.64 | — | — | |
| SCHEMBL25143561 | 0.64 | — | — |
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-3968109-A | ANTIBIOTIC | E. R. SQUIBB & SONS, INC. (US) | 1976-07-06 | — | — | US | claimed |
| US-4071682-A | BACTERICIDES | E. R. SQUIBB & SONS, INC. (US) | 1978-01-31 | — | — | US | disclosed |
| US-3968109-A | ANTIBIOTIC | E. R. SQUIBB & SONS, INC. (US) | 1976-07-06 | — | — | US | disclosed |