⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL534090 | 0.67 | — | — | |
| SCHEMBL3084499 | 0.66 | CYP2C19 (0.39) | — | |
| SCHEMBL8546229 | 0.62 | — | — | |
| SCHEMBL845998 | 0.62 | — | — | |
| SCHEMBL14272008 | 0.59 | — | — | |
| SCHEMBL845770 | 0.57 | — | — | |
| SCHEMBL131709 | 0.57 | — | — | |
| SCHEMBL12633927 | 0.57 | — | — | |
| SCHEMBL845771 | 0.57 | — | — | |
| SCHEMBL7044598 | 0.57 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1697309-A2 | BENZOYL-SUBSTITUTED PHENYLALANINE AMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005061443-A2 | BENZOYL-SUBSTITUTED PHENYLALANINE AMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2005-07-07 | — | — | WO | disclosed |