⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4866178 | 1.00 | — | — | |
| SCHEMBL28034175 | 0.97 | OR51E2 (0.38) | — | |
| SCHEMBL3505065 | 0.78 | — | — | |
| SCHEMBL3505066 | 0.78 | — | — | |
| SCHEMBL8943586 | 0.78 | ALDH1A1 (0.36) | — | |
| SCHEMBL34656 | 0.77 | — | — | |
| SCHEMBL360177 | 0.77 | — | — | |
| SCHEMBL34657 | 0.77 | — | — | |
| SCHEMBL9225657 | 0.77 | — | — | |
| SCHEMBL8181223 | 0.76 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090211346-A1 | Methods for Detecting Alzheimer's Disease | BG MEDICINE, INC. | 2009-08-27 | — | — | US | claimed |
| EP-1869474-A1 | METHODS FOR DETECTING ALZHEIMER'S DISEASE | BG Medicine, Inc. (US) | 2007-12-26 | — | — | EP | claimed |
| WO-2006099377-A1 | METHODS FOR DETECTING ALZHEIMER'S DISEASE | BG MEDICINE, INC. (US) | 2006-09-21 | — | — | WO | claimed |
| US-20120231972-A1 | Probe Compound for Detecting and Isolating Enzymes and Means and Methods Using the Same | INSTITUTE OF CATALYSIS (CSIC) (ES) | 2012-09-13 | — | — | US | disclosed |
| US-8206986-B2 | Methods for detecting Alzheimer's disease | BG MEDICINE, INC. (US) | 2012-06-26 | — | — | US | disclosed |
| WO-2010105851-A1 | PROBE COMPOUND FOR DETECTING AND ISOLATING ENZYMES AND MEANS AND METHODS USING THE SAME | Helmholtz-Zentrum für Infektionsforschung GmbH (DE) | 2010-09-23 | — | — | WO | disclosed |
| EP-2230312-A1 | Probe compound for detecting and isolating enzymes and means and methods using the same | Helmholtz-Zentrum für Infektionsforschung GmbH (DE) | 2010-09-22 | — | — | EP | disclosed |
| US-20090211346-A1 | Methods for Detecting Alzheimer's Disease | BG MEDICINE, INC. | 2009-08-27 | — | — | US | disclosed |
| EP-1869474-A1 | METHODS FOR DETECTING ALZHEIMER'S DISEASE | BG Medicine, Inc. (US) | 2007-12-26 | — | — | EP | disclosed |
| WO-2006099377-A1 | METHODS FOR DETECTING ALZHEIMER'S DISEASE | BG MEDICINE, INC. (US) | 2006-09-21 | — | — | WO | disclosed |