⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30159668 | 0.89 | — | — | |
| SCHEMBL30538634 | 0.89 | — | — | |
| SCHEMBL27534897 | 0.89 | — | — | |
| SCHEMBL15756636 | 0.89 | — | — | |
| SCHEMBL21641 | 0.89 | — | — | |
| SCHEMBL25404221 | 0.87 | — | — | |
| SCHEMBL19133 | 0.87 | — | — | |
| Calcium SCHEMBL317563 | 0.82 | — | — | |
| Magnesium SCHEMBL31674361 | 0.82 | — | — | |
| SCHEMBL1114282 | 0.82 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0673439-B2 | Method for detecting environmental insults | DU PONT (US) | 2001-07-04 | — | — | EP | disclosed |
| EP-0943000-A1 | A SMALL VOLUME, HIGHLY SENSITIVE METHOD FOR DETECTING ENVIRONMENTAL INSULTS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1999-09-22 | — | — | EP | disclosed |
| WO-1998021347-A1 | A SMALL VOLUME, HIGHLY SENSITIVE METHOD FOR DETECTING ENVIRONMENTAL INSULTS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1998-05-22 | — | — | WO | disclosed |
| US-5683868-A | GENETICALLY ENGINEERED E. COLI, BIOLUMINESCENCE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1997-11-04 | — | — | US | disclosed |
| EP-0673439-B1 | Method for detecting environmental insults | DU PONT (US) | 1997-04-23 | — | — | EP | disclosed |
| EP-0673439-A1 | A HIGHLY SENSITIVE METHOD FOR DETECTING ENVIRONMENTAL INSULTS. | DU PONT (US) | 1995-09-27 | — | — | EP | disclosed |
| WO-1994013831-A1 | A HIGHLY SENSITIVE METHOD FOR DETECTING ENVIRONMENTAL INSULTS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1994-06-23 | — | — | WO | disclosed |