Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.50 |
| ▸ | PPARA | Q07869 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.49 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1802183 | 0.92 | ALDH1A1 (0.56) | PPARGPPARAALDH1A1MAPTKDM4E | |
| SCHEMBL7332474 | 0.87 | TAAR1 (0.61) | MTNR1AMTNR1BHDAC1HDAC6TAAR1 | |
| SCHEMBL1856638 | 0.86 | PPARA (0.59) | PPARGPPARAALDH1A1MAPTKDM4E | |
| SCHEMBL1206811 | 0.85 | HDAC1 (0.64) | PPARGPPARAMTNR1AMTNR1BHDAC1 | |
| SCHEMBL13545161 | 0.84 | MTNR1A (0.61) | MTNR1AMTNR1BHDAC1HDAC6TAAR1 | |
| SCHEMBL17274751 | 0.84 | HDAC1 (0.66) | PPARGPPARAMTNR1AMTNR1BHDAC1 | |
| SCHEMBL2891622 | 0.81 | TDP1 (0.56) | PPARGPPARAALDH1A1MAPTTDP1 | |
| SCHEMBL28295600 | 0.81 | TDP1 (0.61) | ALDH1A1TDP1 | |
| SCHEMBL7317315 | 0.81 | EPHX2 (0.62) | MTNR1AMTNR1BHDAC1HDAC6CYP1A2 | |
| SCHEMBL10444982 | 0.80 | PPARA (0.61) | PPARGPPARAALDH1A1KDM4ETDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109678902-B | Organic catalyst with rigid spiro [ indan-1, 2' -pyrrolidine ] skeleton, ligand, synthesis and application | 北京师范大学 | 2020-05-15 | — | — | CN | disclosed |
| CN-109678902-A | One kind has the organic catalyst, ligand and synthesis and application of rigid spiral shell [indane -1,2 '-pyrrolidines] skeleton | 北京师范大学 | 2019-04-26 | — | — | CN | disclosed |