⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3020114 | 1.00 | — | — | |
| SCHEMBL2459531 | 1.00 | — | — | |
| SCHEMBL9307779 | 0.84 | GABRR1 (0.35) | — | |
| SCHEMBL9307785 | 0.84 | GABRR1 (0.35) | — | |
| SCHEMBL462085 | 0.78 | — | — | |
| SCHEMBL265253 | 0.78 | — | — | |
| SCHEMBL462086 | 0.78 | — | — | |
| SCHEMBL28682251 | 0.75 | — | — | |
| SCHEMBL29274488 | 0.75 | — | — | |
| SCHEMBL28417021 | 0.75 | — | — |
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-0371264-B1 | Phosphonate reagent compositions and methods of making same | UNIV LOYOLA CHICAGO (US) | 1994-09-14 | — | — | EP | claimed |
| EP-0371264-A2 | Phosphonate reagent compositions and methods of making same | LOYOLA UNIVERSITY OF CHICAGO (US) | 1990-06-06 | — | — | EP | claimed |
| US-8017596-B2 | Phosphonates useful as modulators of T-γ-9-δ-2 activity | INNATE PHARMA, S.A. (FR) | 2011-09-13 | — | — | US | disclosed |
| US-20100204184-A1 | Phosphonates useful as modulators of T-gamma-9-delta-2 activity | LABORATOIRES MAYOLY SPINDLER (FR) | 2010-08-12 | — | — | US | disclosed |
| US-20060241087-A1 | Phosphonates useful as modulators of t $g(g)9$g(d)2 lymphocyte activity | MONTERO JEAN-LOUIS | 2006-10-26 | — | — | US | disclosed |
| US-5061819-A | Methods for synthesizing phosphonate reagents and retinoids | LOYOLA UNIVERSITY OF CHICAGO (US) | 1991-10-29 | — | — | US | disclosed |