⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL460015 | 0.73 | — | — | |
| SCHEMBL6355869 | 0.73 | — | — | |
| SCHEMBL27890644 | 0.73 | — | — | |
| SCHEMBL8931943 | 0.69 | — | — | |
| SCHEMBL4147210 | 0.69 | — | — | |
| SCHEMBL1778868 | 0.68 | — | — | |
| SCHEMBL1703855 | 0.67 | — | — | |
| SCHEMBL28364291 | 0.67 | — | — | |
| SCHEMBL10864052 | 0.67 | ALDH1A1 (0.41) | — | |
| SCHEMBL1702266 | 0.67 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6149927-A | FOR CONTROLLING OR INHIBITING GROWTH OF MICROORGANISMS | ROHM AND HAAS COMPANY (US) | 2000-11-21 | — | — | US | disclosed |
| US-6090399-A | POROUS MATRIX | ROHM AND HAAS COMPANY (US) | 2000-07-18 | — | — | US | disclosed |
| EP-1008296-A1 | Alkoxy disulfides as antimicrobial agents | ROHM AND HAAS COMPANY (US) | 2000-06-14 | — | — | EP | disclosed |
| EP-0997068-A1 | Synergistic microbicidal combinations | ROHM AND HAAS COMPANY (US) | 2000-05-03 | — | — | EP | disclosed |
| EP-0922386-A2 | Controlled release compositions | ROHM AND HAAS COMPANY (US) | 1999-06-16 | — | — | EP | disclosed |
| EP-0897666-A1 | Solid biocidal compositions | ROHM AND HAAS COMPANY (US) | 1999-02-24 | — | — | EP | disclosed |
| US-5874476-A | MICROBIOCIDES | ROHM AND HAAS COMPANY (US) | 1999-02-23 | — | — | US | disclosed |
| EP-0824862-A1 | Dihaloformaldoxime carbamates as antimicrobial agents | ROHM AND HAAS COMPANY (US) | 1998-02-25 | — | — | EP | disclosed |