⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL381512 | 1.00 | — | — | |
| SCHEMBL1501596 | 1.00 | — | — | |
| SCHEMBL28401151 | 0.97 | ALDH1A1 (0.45) | — | |
| Succinic Acid SCHEMBL3145429 | 0.90 | FFAR3 (0.48) | — | |
| Maleic Acid SCHEMBL19611146 | 0.88 | HCAR2 (0.42) | — | |
| SCHEMBL9082385 | 0.86 | TET2 (0.38) | — | |
| Cadaverine Tartrate SCHEMBL7865978 | 0.86 | TSHR (0.43) | — | |
| SCHEMBL6054231 | 0.84 | ALDH1A1 (0.56) | — | |
| SCHEMBL381209 | 0.83 | TSHR (0.43) | — | |
| SCHEMBL605019 | 0.83 | TSHR (0.43) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090325155-A1 | Aureobasin a synthetase | AUREOGEN BIOSCIENCES, INC. | 2009-12-31 | — | — | US | disclosed |
| US-6384228-B2 | EPIBATIDINE; ANALGESICS; ANIMAL EXTRACTS | NIHON MEDI-PHYSICS CO., LTD. (JP) | 2002-05-07 | — | — | US | disclosed |
| US-20020010339-A1 | METHOD FOR SYNTHESIS OF HALOPYRIDYL-ACYCLOPENTANE DERIVATIVE AND INTERMEDIATE THEREOF | NIHON MEDI-PHYSICS CO., LTD. (JP) | 2002-01-24 | — | — | US | disclosed |
| EP-0581429-B1 | Process for synthesizing cyclic depsipeptides | TAKARA SHUZO CO (JP) | 1997-09-03 | — | — | EP | disclosed |
| US-5633345-A | FUNGICIDE | TAKARA SHUZO CO., LTD. (JP) | 1997-05-27 | — | — | US | disclosed |
| US-5633346-A | CYCLIZATION, FUNGICIDES | TAKARA SHUZO CO., LTD. (JP) | 1997-05-27 | — | — | US | disclosed |
| EP-0581429-A2 | Process for synthesizing cyclic depsipeptides | TAKARA SHUZO CO. LTD. (JP) | 1994-02-02 | — | — | EP | disclosed |