Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | TEAD2 | Q15562 | 1/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.33 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6139367 | 0.91 | TSHR (0.38) | KIF11CYP2C19FFAR1TSHRCASP1 | |
| SCHEMBL7953170 | 0.89 | KIF11 (0.35) | KIF11CYP2C19FFAR1TSHRFFAR4 | |
| SCHEMBL6139488 | 0.89 | KIF11 (0.35) | KIF11CYP2C19FFAR1TSHRFFAR4 | |
| SCHEMBL7749391 | 0.84 | MIF (0.37) | KIF11CYP2C19FFAR1TSHRSSTR4 | |
| SCHEMBL7957554 | 0.83 | SLC6A2 (0.32) | KIF11CYP2C19FFAR1TSHRCASP1 | |
| SCHEMBL7077078 | 0.83 | SLC6A2 (0.32) | KIF11CYP2C19FFAR1TSHRCASP1 | |
| SCHEMBL7768725 | 0.82 | MIF (0.42) | KIF11CYP2C19TSHRMRGPRX4 | |
| SCHEMBL8445608 | 0.82 | TSHR (0.40) | KIF11TSHRCASP1HSD17B10SSTR4 | |
| SCHEMBL6544463 | 0.82 | L3MBTL1 (0.41) | CYP2C19FFAR1TSHRCASP1HSD17B10 | |
| SCHEMBL6955463 | 0.81 | ALDH1A1 (0.35) | KIF11CYP2C19FFAR1TSHRHSD17B10 |
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-6242607-B1 | SUCH AS 4-CYANO-4-(3,4-DICHLOROPHENYL)HEPTANEDIOIC ACID USED AS ANTAGONISTS OF NEUROKININES | SANOFI-SYNTHELABO (FR) | 2001-06-05 | — | — | US | disclosed |
| US-6008360-A | Substituted 3-aryl-3-carboxyalkyl glutaramides, method for preparing same by 4-arylo-4-cyanoheptane dicarboxylic acid cyclisation, and use thereof for preparing 3-aryl-3-hydroxyalkylpiperidines | SANOFI-SYNTHELABO (FR) | 1999-12-28 | — | — | US | disclosed |