⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18099913 | 1.00 | — | — | |
| SCHEMBL7795804 | 0.76 | — | — | |
| SCHEMBL442109 | 0.72 | — | — | |
| SCHEMBL4884922 | 0.69 | — | — | |
| SCHEMBL5728624 | 0.69 | — | — | |
| SCHEMBL2396668 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL3033584 | 0.69 | — | — | |
| Hydrogen Sulfide SCHEMBL8742082 | 0.69 | — | — | |
| SCHEMBL12259629 | 0.69 | — | — | |
| Isopropylamine SCHEMBL28259841 | 0.69 | TSHR (0.39) | — |
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-2121583-A1 | HETEROARYL-SUBSTITUTED SERINE AMIDES | BASF SE (DE) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008084073-A1 | HETEROARYL-SUBSTITUTED SERINE AMIDES | BASF SE (DE) | 2008-07-17 | — | — | WO | disclosed |
| EP-1716120-A1 | HERBICIDAL HETEROAROYL-SUBSTITUTED PHENYLALANINE AMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2006-11-02 | — | — | EP | disclosed |
| EP-1697309-A2 | BENZOYL-SUBSTITUTED PHENYLALANINE AMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005061464-A1 | HERBICIDAL HETEROAROYL-SUBSTITUTED PHENYLALANINE AMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2005-07-07 | — | — | WO | disclosed |
| WO-2005061443-A2 | BENZOYL-SUBSTITUTED PHENYLALANINE AMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2005-07-07 | — | — | WO | disclosed |