Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.39 |
| ▸ | DNMT3B | Q9UBC3 | 1/20 | 0.39 |
| ▸ | DNMT3L | Q9UJW3 | 1/20 | 0.39 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | CDC25B | P30305 | 2/20 | 0.38 |
| ▸ | CASP6 | P55212 | 1/20 | 0.38 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.38 |
| ▸ | TGM2 | P21980 | 1/20 | 0.37 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | HNF4A | P41235 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9080204 | 1.00 | CYP2C9 (0.39) | CYP2C9CYP2C19CYP1A2KLKB1CTSB | |
| SCHEMBL9080211 | 0.76 | KLKB1 (0.35) | CYP2C19CYP1A2KLKB1CTSBMMP9 | |
| SCHEMBL5682297 | 0.75 | CYP2C9 (0.53) | CYP2C9CYP2C19CYP1A2ALDH1A1TGM2 | |
| SCHEMBL7562901 | 0.75 | KDM4E (0.55) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL559523 | 0.73 | TGM2 (0.40) | CYP2C9CYP2C19CYP1A2CTSBALDH1A1 | |
| SCHEMBL16835972 | 0.73 | ALDH1A1 (0.48) | CYP2C9CYP2C19CYP1A2ALDH1A1TGM2 | |
| SCHEMBL11515828 | 0.73 | NPC1 (0.43) | CYP2C9CYP2C19CYP1A2ALDH1A1TGM2 | |
| SCHEMBL16836020 | 0.72 | LMNA (0.51) | CYP2C9CYP2C19CYP1A2ALDH1A1POLB | |
| SCHEMBL28222381 | 0.72 | CFD (0.46) | CYP2C9CYP2C19CYP1A2KLKB1CTSB | |
| SCHEMBL7852526 | 0.72 | CFD (0.46) | CYP2C9CYP2C19CYP1A2KLKB1CTSB |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996034851-A1 | BENZENE, PYRIDINE, NAPHTALENE OR BENZOPHENONE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE | ABBOTT LABORATORIES (US) | 1996-11-07 | — | — | WO | disclosed |