⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL797535 | 0.79 | — | — | |
| SCHEMBL26134640 | 0.77 | — | — | |
| SCHEMBL27553208 | 0.77 | — | — | |
| SCHEMBL28667138 | 0.76 | — | — | |
| SCHEMBL27901874 | 0.76 | — | — | |
| SCHEMBL28166935 | 0.75 | — | — | |
| Fluoride SCHEMBL27841847 | 0.74 | — | — | |
| SCHEMBL9868040 | 0.74 | — | — | |
| SCHEMBL29077415 | 0.74 | — | — | |
| SCHEMBL30476273 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3814485-A1 | NATURAL KILLER CELLS | Imperial College Innovations Limited (GB) | 2021-05-05 | — | — | EP | disclosed |
| WO-2017079120-A1 | ROR GAMMA AGONISTS AS ENHANCERS OF PROTECTIVE IMMUNITY | THE SCRIPPS RESEARCH INSTITUTE (US) | 2017-05-11 | — | — | WO | disclosed |
| WO-2016146689-A1 | ORGANOZINC REAGENTS AND PROCESSES FOR PREPARING AND USING THE SAME | LUDWIG-MAXIMILIANS-UNIVERSITÄT MÜNCHEN (DE) | 2016-09-22 | — | — | WO | disclosed |
| EP-1711617-A1 | METHOD AND COMPOSITIONS FOR IDENTIFYING ANTI-HIV THERAPEUTICS COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2006-10-18 | — | — | EP | disclosed |
| WO-2005064008-A1 | METHOD AND COMPOSITIONS FOR IDENTIFYING ANTI-HIV THERAPEUTIC COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2005-07-14 | — | — | WO | disclosed |