⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7944501 | 0.80 | ALDH1A1 (0.40) | — | |
| SCHEMBL1004215 | 0.78 | — | — | |
| SCHEMBL17728713 | 0.75 | — | — | |
| SCHEMBL9185177 | 0.75 | — | — | |
| SCHEMBL17728716 | 0.75 | — | — | |
| SCHEMBL15019465 | 0.75 | — | — | |
| SCHEMBL9805417 | 0.74 | — | — | |
| SCHEMBL809367 | 0.73 | — | — | |
| SCHEMBL6228148 | 0.73 | — | — | |
| SCHEMBL728264 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2236464-B1 | Use of a microorganism-immobilized carrier for removal of exogenous endocrine disrupting compounds | HITACHI PLANT TECHNOLOGIES LTD (JP) | 2013-03-20 | — | — | EP | disclosed |
| EP-1227065-B1 | Method of removing exogenous endocrine-disrupting chemical (environmental hormonal substances) in water | HITACHI PLANT TECHNOLOGIES LTD (JP) | 2010-11-03 | — | — | EP | disclosed |
| EP-2236464-A2 | Method of producing a microorganism-immobilized carrier | Hitachi Plant Technologies, Ltd. (JP) | 2010-10-06 | — | — | EP | disclosed |
| US-7105337-B2 | Method of removing exogenous endocrine-disrupting chemical in water | HITACHI PLANT ENGINEERING & CONSTRUCTION CO., LTD. (JP) | 2006-09-12 | — | — | US | disclosed |
| US-20020103347-A1 | Method of removing exogenous endocrine-disrupting chemical in water | HITACHI PLANT ENGINEERING & CONSTRUCTION CO., LTD. (JP) | 2002-08-01 | — | — | US | disclosed |
| EP-1227065-A2 | Method of removing exogenous endocrine-disrupting chemical in water | Hitachi Plant Engineering & Construction Co., Ltd. (JP) | 2002-07-31 | — | — | EP | disclosed |