⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6544672 | 1.00 | — | — | |
| SCHEMBL9468053 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL10755119 | 0.97 | — | — | |
| Acetic Acid SCHEMBL1815087 | 0.93 | CTH (0.39) | — | |
| Acetic Acid SCHEMBL1815722 | 0.93 | CTH (0.39) | — | |
| SCHEMBL9468246 | 0.78 | — | — | |
| SCHEMBL9468128 | 0.78 | — | — | |
| SCHEMBL7350591 | 0.77 | — | — | |
| SCHEMBL5967483 | 0.76 | GABRP (0.42) | — | |
| SCHEMBL13327105 | 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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-61033149-A | — | — | None | — | — | JP | disclosed |
| WO-2019069297-A2 | PROBE FOR SELECTIVELY CHARACTERIZING ENZYMES INVOLVED IN XENOBIOTIC METABOLISM AND METHOD OF MAKING AND USING THE SAME | KILLINGER, BYRAN J. (US) | 2019-04-11 | — | — | WO | disclosed |
| WO-2019070906-A1 | PROBE FOR SELECTIVELY CHARACTERIZING ENZYMES INVOLVED IN XENOBIOTIC METABOLISM AND METHOD OF MAKING AND USING THE SAME | WRIGHT AARON T (US) | 2019-04-11 | — | — | WO | disclosed |
| US-20120202794-A1 | COMPOUNDS | PHARMASSET, INC. (US) | 2012-08-09 | — | — | US | disclosed |
| WO-2012103113-A1 | PYRAZINE AND IMIDAZOLIDINE DERIVATIVES AND THEIR USES TO TREAT HEPATITIS C | GILEAD PHARMASSET, LLC (US) | 2012-08-02 | — | — | WO | disclosed |
| US-20100093536-A1 | CONTROL OF GRASSY WEEDS WITH VINYLGLYCINES AND VINYLGLYCINE-PRODUCING ORGANISMS | THE STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER | 2010-04-15 | — | — | US | disclosed |
| EP-0931792-B1 | Depsipeptides containing non-natural amino acids | NISSHIN SEIFUN GROUP INC (JP) | 2004-01-07 | — | — | EP | disclosed |
| US-6252041-B1 | Depsipeptides containing non-natural amino acids | NISSHIN FLOUR MILLING CO., LTD. (JP) | 2001-06-26 | — | — | US | disclosed |
| EP-0931792-A1 | Depsipeptides containing non-natural amino acids | Nisshin Flour Milling Co., Ltd. (JP) | 1999-07-28 | — | — | EP | disclosed |
| US-5208260-A | Vinyl Glycine derivatives for memory and learning enhancement or treatment of a cognitive disorder | G. D. SEARLE & CO. (US) | 1993-05-04 | — | — | US | disclosed |
| JP-S6133149-A | PREPARATION OF CYCLOPROPYLGLYCINE DERIVATIVE | SUNTORY LTD | 1986-02-17 | — | — | JP | disclosed |