Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL5874105 | 0.92 | ALDH1A1 (0.33) | — | |
| SCHEMBL2786080 | 0.89 | HTT (0.30) | — | |
| SCHEMBL27576738 | 0.89 | HTT (0.30) | — | |
| SCHEMBL27553618 | 0.89 | HTT (0.30) | — | |
| SCHEMBL4101170 | 0.80 | HTT (0.32) | — | |
| SCHEMBL27756624 | 0.77 | ALDH1A1 (0.40) | TSHRCYP2C19GAA | |
| SCHEMBL7718861 | 0.75 | ALDH1A1 (0.36) | — | |
| SCHEMBL27573906 | 0.73 | — | — | |
| SCHEMBL27573913 | 0.73 | — | — | |
| SCHEMBL5874768 | 0.72 | ALDH1A1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-100383121-C | Substituted benzyl ester and its preparation process and novel process for preparing substituted mopipe therefrom | TIANJIN TAIPU PHARMACEUTICAL S (CN) | 2008-04-23 | — | — | CN | disclosed |
| CN-1827598-A | Substituted benzyl ester and its preparation process and novel process for preparing substituted mopipe therefrom | TIANJIN TAIPU PHARMACEUTICAL S (CN) | 2006-09-06 | — | — | CN | disclosed |
| US-6140502-A | Heat-based process for the re-racemisation of a (-)-2-phenylmethyl-3,3-dimethyl-piperidin-4-on derivative | BOEHRINGER INGELHEIM KG (DE) | 2000-10-31 | — | — | US | disclosed |
| US-6136980-A | Method of preparing norbenzomorphane as an intermediate in the preparation of pharmaceutically useful benzomorphane derivatives, in particular (-)-(1R,5S,2\"R)-3'-hydroxy-2-(2-methoxypropyl)-5,9,9-trimethyl-6,7-benzo morphane | BOEHRINGER INGELHEIM KG (DE) | 2000-10-24 | — | — | US | disclosed |
| US-6054604-A | Method of preparing norbenzomorphane as an intermediate | BOEHRINGER INGELHEIM KG (DE) | 2000-04-25 | — | — | US | disclosed |
| US-5945535-A | Method of preparing norbenzomorphanes | BOEHRINGER INGELHEIM KG (DE) | 1999-08-31 | — | — | US | disclosed |