Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | PKM | P14618 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MPI | P34949 | 1/20 | 0.33 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.33 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | APP | P05067 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | SNCA | P37840 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19297690 | 0.89 | ALDH1A1 (0.37) | BRD4CYP1B1ALDH1A1PKMKDM4E | |
| SCHEMBL19297692 | 0.89 | ALDH1A1 (0.37) | BRD4CYP1B1ALDH1A1PKMKDM4E | |
| SCHEMBL19297691 | 0.89 | ALDH1A1 (0.37) | BRD4CYP1B1ALDH1A1PKMKDM4E | |
| SCHEMBL19308146 | 0.83 | CYP1B1 (0.38) | BRD4CYP1B1ALDH1A1CASP1SMN1; SMN2 | |
| SCHEMBL19308152 | 0.83 | TNKS2 (0.33) | BRD4ALDH1A1 | |
| SCHEMBL19308157 | 0.80 | BRD4 (0.52) | BRD4ALDH1A1PKMKDM4EHPGD | |
| SCHEMBL19309407 | 0.80 | KDM4E (0.33) | ALDH1A1KDM4E | |
| SCHEMBL21998588 | 0.79 | ALDH1A1 (0.34) | ALDH1A1PKMKDM4EALOX15KMT2A | |
| SCHEMBL21998585 | 0.79 | CYP1B1 (0.41) | BRD4CYP1B1ALDH1A1PKMKDM4E | |
| SCHEMBL19308167 | 0.79 | CYP1B1 (0.41) | BRD4CYP1B1ALDH1A1PKMKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-9751896-B1 | Asymmetric 7-N isatin dimer Schiff base compounds with antitumor activities and a method of preparing the same | SHAANXI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2017-09-05 | — | — | US | disclosed |
| US-9751896-B1 | Asymmetric 7-N isatin dimer Schiff base compounds with antitumor activities and a method of preparing the same | SHAANXI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2017-09-05 | — | — | US | disclosed |