Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PDE9A | O76083 | 7/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.32 |
| ▸ | P2RY12 | Q9H244 | 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 | |
|---|---|---|---|---|
| SCHEMBL28793458 | 0.91 | KDM4E (0.38) | KDM4EALDH1A1TDP1PDE9AL3MBTL1 | |
| SCHEMBL28793466 | 0.89 | PDE9A (0.33) | KDM4EALDH1A1TDP1PDE9AL3MBTL1 | |
| SCHEMBL23500613 | 0.84 | JAK3 (0.35) | KDM4EALDH1A1PDE9AL3MBTL1CNR2 | |
| SCHEMBL28793472 | 0.80 | PTPN11 (0.36) | CNR2KMT2AMEN1PTPN11 | |
| SCHEMBL28693976 | 0.80 | PTPN11 (0.37) | PDE9APTPN11 | |
| SCHEMBL23500639 | 0.79 | RET (0.35) | KDM4EALDH1A1TDP1HPGDHSD17B10 | |
| SCHEMBL28945530 | 0.78 | PTPN11 (0.32) | KDM4EALDH1A1TDP1CNR2KMT2A | |
| SCHEMBL23500612 | 0.75 | RET (0.46) | CNR2 | |
| SCHEMBL28779227 | 0.74 | KDM4E (0.38) | KDM4EALDH1A1TDP1KMT2AMEN1 | |
| SCHEMBL28779203 | 0.74 | GPR119 (0.36) | KDM4EALDH1A1TDP1PDE9AL3MBTL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114829362-A | Six-membered and five-membered aromatic ring derivative containing nitrogen heteroatom and used as SHP2 inhibitor | 成都倍特药业股份有限公司 | 2022-07-29 | — | — | CN | disclosed |