⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1527955 | 1.00 | — | — | |
| SCHEMBL4823861 | 0.74 | — | — | |
| SCHEMBL4820307 | 0.74 | — | — | |
| SCHEMBL4823858 | 0.74 | — | — | |
| Trichloroethylene SCHEMBL11612308 | 0.73 | TSHR (0.67) | — | |
| Hypochlorous Acid SCHEMBL27758664 | 0.71 | — | — | |
| SCHEMBL6957609 | 0.70 | — | — | |
| SCHEMBL3625668 | 0.70 | — | — | |
| Trichloroethylene SCHEMBL242488 | 0.67 | — | — | |
| Trichloroethylene SCHEMBL1331201 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7462480-B2 | Stimulation of microbial dechlorination of polychorinated biphenyls with halogenated ethenes | UNIVERSITY OF MARYLAND BIOTECHNOLOGY INSTITUTE (US) | 2008-12-09 | — | — | US | claimed |
| US-20060057705-A1 | Stimulation of microbial dechlorination of polychlorinated biphenyls with halogenated ethenes | UNIVERSITY OF MARYLAND BALTIMORE COUNTY | 2006-03-16 | — | — | US | claimed |
| US-7462480-B2 | Stimulation of microbial dechlorination of polychorinated biphenyls with halogenated ethenes | UNIVERSITY OF MARYLAND BIOTECHNOLOGY INSTITUTE (US) | 2008-12-09 | — | — | US | disclosed |
| US-20060057705-A1 | Stimulation of microbial dechlorination of polychlorinated biphenyls with halogenated ethenes | UNIVERSITY OF MARYLAND BALTIMORE COUNTY | 2006-03-16 | — | — | US | disclosed |
| WO-2003065011-A2 | STIMULATION OF MICROBIAL DECHLORINATION OF POLYCHLORINATED BIPHENYLS WITH HALOGENATED ETHENES | UNIVERSITY OF MARYLAND BIOTECHNOLOGY INSTITUTE (US) | 2003-08-07 | — | — | WO | disclosed |