⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8380251 | 0.91 | TSHR (0.30) | — | |
| SCHEMBL26220 | 0.74 | — | — | |
| SCHEMBL27570683 | 0.64 | KDM4E (0.36) | — | |
| SCHEMBL5521795 | 0.64 | — | — | |
| SCHEMBL2057175 | 0.63 | — | — | |
| SCHEMBL4728832 | 0.63 | — | — | |
| SCHEMBL560211 | 0.62 | — | — | |
| SCHEMBL6849718 | 0.61 | — | — | |
| SCHEMBL6849723 | 0.61 | — | — | |
| SCHEMBL1524599 | 0.61 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008027995-A2 | RADIO-LABELED MATERIALS AND METHODS OF MAKING AND USING THE SAME | BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) | 2008-03-06 | — | — | WO | claimed |
| EP-4028592-B1 | METHOD FOR MODIFYING A YARN OR TEXTILE FABRIC | CENTRE NAT RECH SCIENT (FR) | 2023-10-04 | — | — | EP | disclosed |
| WO-2013048811-A1 | IMAGING AND RADIOTHERAPY METHODS FOR TUMOUR STEM CELLS | GE HEALTHCARE LIMITED (GB) | 2013-04-04 | — | — | WO | disclosed |
| EP-1999114-A2 | PYRAZOLES AS 11-BETA-HSD-1 | F. Hoffmann-la Roche AG (CH) | 2008-12-10 | — | — | EP | disclosed |
| WO-2007107470-A2 | PYRAZOLES AS 11-BETA-HSD-1 | F. HOFFMANN-LA ROCHE AG (CH) | 2007-09-27 | — | — | WO | disclosed |
| US-20070036722-A1 | Separation processes | RONGVED PAL | 2007-02-15 | — | — | US | disclosed |
| EP-1073716-B1 | IMPROVEMENTS IN OR RELATING TO SEPARATION PROCESSES | AMERSHAM HEALTH AS (NO) | 2004-04-28 | — | — | EP | disclosed |
| US-6689588-B1 | USE IN COLUMN CONTAINING THE IMMOBILIZED ALLIINASE AND COLLECTING PURE ALLICIN IN EFFLUENT; PURE ALLICIN HAS AS FOOD ADDITIVE OR PHARMACEUTICAL FOR INFECTIONS, THROMBOSIS OR HYPERLIPIDEMIA | YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) | 2004-02-10 | — | — | US | disclosed |
| US-20030104359-A1 | Separation processes | NYCOMED IMAGING AS (NO) | 2003-06-05 | — | — | US | disclosed |
| EP-0786087-B1 | POLYPEPTIDE-DENDRIMER COMPLEXES | DADE BEHRING INC (US) | 2002-02-27 | — | — | EP | disclosed |
| US-6083708-A | BRANCHING COMPOUND WITH AT LEAST TWO TERMINI, EACH OF WHICH HAS PREFERENTIAL ENZYME ACTIVITY | DADE BEHRING INC. (US) | 2000-07-04 | — | — | US | disclosed |
| WO-2000027813-A1 | AZOBENZENE DERIVATIVES AS LABELING AGENTS AND INTERMEDIATES THEREOF | YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) | 2000-05-18 | — | — | WO | disclosed |