⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL234550 | 0.82 | CYP3A4 (0.42) | — | |
| SCHEMBL356683 | 0.82 | CYP3A4 (0.42) | — | |
| SCHEMBL4619337 | 0.81 | CYP3A4 (0.41) | — | |
| SCHEMBL16180769 | 0.81 | CYP3A4 (0.41) | — | |
| SCHEMBL5330004 | 0.74 | ESR1 (0.36) | — | |
| SCHEMBL4744273 | 0.70 | CYP3A4 (0.31) | — | |
| SCHEMBL1443600 | 0.70 | CYP2A6 (0.35) | — | |
| SCHEMBL1460886 | 0.67 | CYP2A6 (0.35) | — | |
| SCHEMBL29350037 | 0.67 | ALDH1A1 (0.44) | — | |
| SCHEMBL29496111 | 0.67 | ALDH1A1 (0.44) | — |
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-2621893-A1 | PROCESS FOR THE PREPARATION OF AMINO ACID DERIVATIVES | UCB Pharma GmbH (DE) | 2013-08-07 | — | — | EP | claimed |
| WO-2012041986-A1 | PROCESS FOR THE PREPARATION OF AMINO ACID DERIVATIVES | UCB PHARMA GMBH (DE) | 2012-04-05 | — | — | WO | claimed |
| EP-2621893-A1 | PROCESS FOR THE PREPARATION OF AMINO ACID DERIVATIVES | UCB Pharma GmbH (DE) | 2013-08-07 | — | — | EP | disclosed |
| EP-2531486-A2 | NOVEL PROCESS FOR THE PREPARATION OF NITROGEN SUBSTITUTED AMINOTETRALINS DERIVATIVES | UCB Pharma GmbH (DE) | 2012-12-12 | — | — | EP | disclosed |
| WO-2012041986-A1 | PROCESS FOR THE PREPARATION OF AMINO ACID DERIVATIVES | UCB PHARMA GMBH (DE) | 2012-04-05 | — | — | WO | disclosed |
| WO-2011095539-A2 | NOVEL PROCESS FOR THE PREPARATION OF NITROGEN SUBSTITUTED AMINOTETRALINS DERIVATIVES | UCB PHARMA GMBH (DE) | 2011-08-11 | — | — | WO | disclosed |