Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 7/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16841462 | 0.86 | PRMT1 (0.41) | SMN1; SMN2PRMT1MEN1KMT2A | |
| SCHEMBL25905863 | 0.77 | SMN1; SMN2 (0.35) | TDP1ALDH1A1CYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL963678 | 0.74 | TSHR (0.43) | TSHRTDP1L3MBTL1ESR1ALDH1A1 | |
| SCHEMBL23199851 | 0.73 | ALDH1A1 (0.47) | TSHRTDP1L3MBTL1ALDH1A1LMNA | |
| SCHEMBL16748755 | 0.73 | ALDH1A1 (0.47) | TSHRTDP1L3MBTL1ALDH1A1LMNA | |
| SCHEMBL16391280 | 0.72 | ALDH1A1 (0.45) | TSHRTDP1L3MBTL1ALDH1A1LMNA | |
| SCHEMBL1751400 | 0.71 | FFAR3 (0.44) | MAPK1CYP3A4STAT3 | |
| SCHEMBL3505753 | 0.71 | GLI1 (0.34) | CYP3A4STAT3 | |
| SCHEMBL18466440 | 0.71 | FFAR3 (0.44) | MAPK1CYP3A4STAT3 | |
| SCHEMBL20446702 | 0.71 | GLI1 (0.34) | CYP3A4STAT3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5698253-A | FRESH HERBAL ODOR | QUEST INTERNATIONAL B.V. (NL) | 1997-12-16 | — | — | US | disclosed |
| EP-0673408-B1 | DIMETHYL-CYCLOHEXANECARBOXYLIC ACID ESTERS IN PERFUMERY | QUEST INT (NL) | 1996-07-24 | — | — | EP | disclosed |
| EP-0673408-A1 | DIMETHYL-CYCLOHEXANECARBOXYLIC ACID ESTERS IN PERFUMERY. | QUEST INT (NL) | 1995-09-27 | — | — | EP | disclosed |
| WO-1994013766-A2 | DIMETHYL-CYCLOHEXANECARBOXYLIC ACID ESTERS IN PERFUMERY | QUEST INTERNATIONAL B.V. (NL) | 1994-06-23 | — | — | WO | disclosed |