⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28727342 | 0.78 | — | — | |
| SCHEMBL29141084 | 0.69 | — | — | |
| SCHEMBL10202363 | 0.69 | — | — | |
| SCHEMBL27208021 | 0.65 | — | — | |
| SCHEMBL11802056 | 0.65 | — | — | |
| Ammonia Solution, Strong SCHEMBL11704948 | 0.65 | — | — | |
| SCHEMBL11702833 | 0.65 | — | — | |
| SCHEMBL16173997 | 0.65 | — | — | |
| SCHEMBL11702847 | 0.65 | — | — | |
| SCHEMBL11842311 | 0.63 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6461856-B2 | NUCLEOTIDE SQUENCES CODING DEHYDROGENASE; FOR USE IN POLLUTION CONTROL | E. I. DU PONT DE NEMOURS & COMPANY | 2002-10-08 | — | — | US | disclosed |
| US-20020042117-A1 | Genes encoding picric acid degradation | ROUVIERE PIERRE E (US) | 2002-04-11 | — | — | US | disclosed |
| US-6355470-B1 | Genes encoding picric acid degradation | E. I. DU PONT DE NEMOURS AND COMPANY | 2002-03-12 | — | — | US | disclosed |
| US-5543324-A | BACTERIA MIXTURE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-08-06 | — | — | US | disclosed |
| US-5478743-A | Microbially mediated degradation of nitrogen-containing phenol compounds by single bacterial isolates | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1995-12-26 | — | — | US | disclosed |
| WO-1995024465-A1 | SINGLE BACTERIAL ISOLATES FOR THE DEGRADATION OF NITROGEN CONTAINING PHENOL COMPOUNDS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1995-09-14 | — | — | WO | disclosed |