⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2562325 | 0.83 | DPP4 (0.31) | — | |
| SCHEMBL2558329 | 0.83 | DPP4 (0.31) | — | |
| SCHEMBL1989780 | 0.83 | DPP4 (0.31) | — | |
| SCHEMBL10753923 | 0.81 | — | — | |
| SCHEMBL9512955 | 0.78 | — | — | |
| SCHEMBL1062003 | 0.74 | — | — | |
| SCHEMBL6383591 | 0.74 | — | — | |
| SCHEMBL6843137 | 0.74 | — | — | |
| SCHEMBL542356 | 0.70 | CYP1A2 (0.30) | — | |
| SCHEMBL20395074 | 0.68 | CYP2D6 (0.46) | — |
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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-3912798-B2 | — | — | 2007-05-09 | — | — | JP | claimed |
| EP-0979827-A1 | Peptides having tachykinin antagonist activity, a process for preparation thereof and pharmaceutical compositions comprising the same | Boehringer Ingelheim Pharma KG (DE) | 2000-02-16 | — | — | EP | claimed |
| JP-2000501382-A | — | — | 2000-02-08 | — | — | JP | claimed |
| EP-0610487-B1 | NEW AMINOACID DERIVATES, PROCESS FOR PRODUCING THE SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM PHARMA (DE) | 1999-11-10 | — | — | EP | claimed |
| EP-0871653-A1 | NOVEL AMINO ACID DERIVATIVES, METHODS OF PRODUCING THEM, AND PHARMACEUTICAL COMPOUNDS CONTAINING THESE COMPOUNDS | Boehringer Ingelheim Pharma GmbH & Co.KG (DE) | 1998-10-21 | — | — | EP | claimed |
| JP-2801087-B2 | — | — | 1998-09-21 | — | — | JP | claimed |
| EP-0804463-A1 | NEUROKININE (TACHYKININE) ANTAGONISTS | BOEHRINGER INGELHEIM KG (DE) | 1997-11-05 | — | — | EP | claimed |
| EP-0802922-A1 | NOVEL AMINO ACID DERIVATIVES, METHOD OF PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM KG (DE) | 1997-10-29 | — | — | EP | claimed |
| WO-1997017362-A1 | NOVEL AMINO ACID DERIVATIVES, METHODS OF PRODUCING THEM, AND PHARMACEUTICAL COMPOUNDS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM KG (DE) | 1997-05-15 | — | — | WO | claimed |
| WO-1995030687-A1 | NEUROKININE (TACHYKININE) ANTAGONISTS | BOEHRINGER INGELHEIM KG (DE) | 1995-11-16 | — | — | WO | claimed |
| WO-1995023810-A1 | NOVEL AMINO ACID DERIVATIVES, METHOD OF PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM KG (DE) | 1995-09-08 | — | — | WO | claimed |
| EP-0394989-B1 | Peptide compounds, process for preparation thereof and pharmaceutical composition comprising the same | FUJISAWA PHARMACEUTICAL CO (JP) | 1994-12-21 | — | — | EP | claimed |
| EP-0610487-A1 | NEW AMINOACID DERIVATES, PROCESS FOR PRODUCING THE SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM KG (DE) | 1994-08-17 | — | — | EP | claimed |
| WO-1994005693-A1 | NEW AMINOACID DERIVATES, PROCESS FOR PRODUCING THE SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM KG (DE) | 1994-03-17 | — | — | WO | claimed |
| EP-0979827-A1 | Peptides having tachykinin antagonist activity, a process for preparation thereof and pharmaceutical compositions comprising the same | Boehringer Ingelheim Pharma KG (DE) | 2000-02-16 | — | — | EP | disclosed |
| EP-0610487-B1 | NEW AMINOACID DERIVATES, PROCESS FOR PRODUCING THE SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM PHARMA (DE) | 1999-11-10 | — | — | EP | disclosed |
| EP-0871653-A1 | NOVEL AMINO ACID DERIVATIVES, METHODS OF PRODUCING THEM, AND PHARMACEUTICAL COMPOUNDS CONTAINING THESE COMPOUNDS | Boehringer Ingelheim Pharma GmbH & Co.KG (DE) | 1998-10-21 | — | — | EP | disclosed |
| WO-1995023810-A1 | NOVEL AMINO ACID DERIVATIVES, METHOD OF PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM KG (DE) | 1995-09-08 | — | — | WO | disclosed |
| EP-0610487-A1 | NEW AMINOACID DERIVATES, PROCESS FOR PRODUCING THE SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM KG (DE) | 1994-08-17 | — | — | EP | disclosed |
| WO-1994005693-A1 | NEW AMINOACID DERIVATES, PROCESS FOR PRODUCING THE SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM KG (DE) | 1994-03-17 | — | — | WO | disclosed |